SCHEMBL61665

SCHEMBL61665

CC(C)c1ccc2nccn2c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.49
KEAP1 Q14145 1/20 0.49
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
KMT2A Q03164 1/20 0.46
MET P08581 2/20 0.42
NQO2 P16083 1/20 0.42
KDM5B Q9UGL1 1/20 0.41
TGFBR1 P36897 6/20 0.39
PIK3CG P48736 1/20 0.38
S1PR3 Q99500 1/20 0.38
NOTUM Q6P988 1/20 0.37
MCHR1 Q99705 1/20 0.37
SSTR4 P31391 1/20 0.36
SYK P43405 1/20 0.36
TGFBR2 P37173 1/20 0.36
DAO P14920 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12489426 0.85 DYRK1A (0.46) DYRK1AKEAP1MEN1CYP1A2KMT2A
SCHEMBL12489541 0.85 KEAP1 (0.50) DYRK1AKEAP1MEN1CYP1A2KMT2A
SCHEMBL24032027 0.85 KEAP1 (0.50) DYRK1AKEAP1MEN1CYP1A2KMT2A
Hydrochloric Acid SCHEMBL26644030 0.84 KEAP1 (0.49) DYRK1AKEAP1MEN1CYP1A2KMT2A
Hydrochloric Acid SCHEMBL28563494 0.84 KEAP1 (0.49) DYRK1AKEAP1MEN1CYP1A2KMT2A
Hydrochloric Acid SCHEMBL28563492 0.84 KEAP1 (0.49) DYRK1AKEAP1MEN1CYP1A2KMT2A
Hydrochloric Acid SCHEMBL26644023 0.84 KEAP1 (0.49) DYRK1AKEAP1MEN1CYP1A2KMT2A
SCHEMBL18885057 0.82 KEAP1 (0.47) DYRK1AKEAP1MEN1CYP1A2KMT2A
SCHEMBL24032026 0.82 DYRK1A (0.44) DYRK1AKEAP1MEN1CYP1A2KMT2A
SCHEMBL20991102 0.82 DYRK1A (0.44) DYRK1AKEAP1MEN1CYP1A2KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 316 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024151833-A1 SPIRO DERIVATIVES AS M4 ACTIVATORS/MODULATORS AND USES THEREOF CEREVEL THERAPEUTICS, LLC (US) 2024-07-18 WO disclosed
US-20240239811-A1 5-(5-(PIPERIDIN-4-YL)THIENO[3,2-C]PYRAZOL-2-YL]INDAZOLE DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS FOR SPLICING NUCLEIC ACIDS AND FOR THE T REMIX THERAPEUTICS INC. 2024-07-18 US disclosed
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides ARVINAS OPERATIONS, INC. (US) 2024-07-16 US disclosed
US-12030878-B2 Substituted indole ether compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-09 US disclosed
US-12030878-B2 Substituted indole ether compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-09 US disclosed
US-20240217990-A1 THIENOPYRROLE COMPOUNDS GILEAD SCIENCES, INC. 2024-07-04 US disclosed
US-20240067638-A1 IMIDAZO[1,2-A]PYRIDINE AND [1,2,4]TRIAZOLO[1,5-A]PYRIDINE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS BRISTOL MYERS SQUIBB CO (US) 2024-02-29 US disclosed
US-20240067638-A1 IMIDAZO[1,2-A]PYRIDINE AND [1,2,4]TRIAZOLO[1,5-A]PYRIDINE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS BRISTOL MYERS SQUIBB CO (US) 2024-02-29 US disclosed
WO-2024044757-A1 AMINOPYRIMIDINE AND AMINOTRIAZINE DERIVATIVES AS MYC PROTEIN MODULATORS Sanford Burnham Prebys Medical Discovery Institute (US) 2024-02-29 WO disclosed
WO-2024044778-A2 NOVEL MODULATORS OF FSHR AND USES THEREOF CELMATIX INC. (US) 2024-02-29 WO disclosed
US-20090253677-A1 HIV Integrase Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2009-10-08 US disclosed
US-20090253677-A1 HIV Integrase Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2009-10-08 US disclosed
US-20090124609-A1 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2009-05-14 US disclosed
US-20090042897-A1 Chemical Compounds GLAXO GROUP LIMITED (GB) 2009-02-12 US disclosed
US-20090042897-A1 Chemical Compounds GLAXO GROUP LIMITED (GB) 2009-02-12 US disclosed
US-20080182839-A1 MODULATORS OF CELLULAR ADHESION SUNESIS PHARMACEUTICALS, INC. (US) 2008-07-31 US disclosed
US-20080176896-A1 Modulators of cellular adhesion BAUSCH + LOMB IRELAND LIMITED (IE) 2008-07-24 US disclosed
US-20080009498-A1 Phosphodiesterase inhibitors and nitric oxide donors, compositions and methods of use NITROMED, INC. (US) 2008-01-10 US disclosed
US-7314938-B2 Immune and/or inflammatory disorders; autoimmune disorders; disorders mediated by the CD11/CD18 family of cellular adhesion molecules (e.g., LFA-1); antagonize CD11/CD18 receptors associated with leukocytes. SUNESIS PHARMACEUTICALS, INC. (US) 2008-01-01 US disclosed
US-7314938-B2 Immune and/or inflammatory disorders; autoimmune disorders; disorders mediated by the CD11/CD18 family of cellular adhesion molecules (e.g., LFA-1); antagonize CD11/CD18 receptors associated with leukocytes. SUNESIS PHARMACEUTICALS, INC. (US) 2008-01-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080176896-A1 Modulators of cellular adhesion ITGB1, VCAM1, ITGB8 DYRK1A 4212/4885KEAP1 2210/4885MEN1 3127/4885
US-12036209-B2 Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides IRAK1, IRAK4, IRAK2 DYRK1A 849/4885KEAP1 283/4885MEN1 2168/4885
US-20080009498-A1 Phosphodiesterase inhibitors and nitric oxide donors, compositions and methods of use PDE3A, PDE3B, PDE2A DYRK1A 2743/4885KEAP1 2501/4885MEN1 2960/4885
US-20240217990-A1 THIENOPYRROLE COMPOUNDS SSB, TPMT, LCP2 DYRK1A 2471/4885KEAP1 655/4885MEN1 2342/4885
US-20090042897-A1 Chemical Compounds NPY5R, NPY1R, NPY2R DYRK1A 272/4885KEAP1 4283/4885MEN1 989/4885
US-20090253677-A1 HIV Integrase Inhibitors DNTT, POLB, UNG DYRK1A 3481/4885KEAP1 4582/4885MEN1 4650/4885
US-20240067638-A1 IMIDAZO[1,2-A]PYRIDINE AND [1,2,4]TRIAZOLO[1,5-A]PYRIDINE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS TLR9, TLR1, TLR7 DYRK1A 2214/4885KEAP1 1739/4885MEN1 4092/4885
US-12030878-B2 Substituted indole ether compounds TLR7, TLR8, TLR1 DYRK1A 2190/4885KEAP1 574/4885MEN1 3173/4885
US-20240239811-A1 5-(5-(PIPERIDIN-4-YL)THIENO[3,2-C]PYRAZOL-2-YL]INDAZOLE DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS FOR SPLICING NUCLEIC ACIDS AND FOR THE T HNRNPAB, HNRNPC, HNRNPA1 DYRK1A 4621/4885KEAP1 806/4885MEN1 3994/4885
US-20080182839-A1 MODULATORS OF CELLULAR ADHESION ITGB1, VCAM1, ITGB8 DYRK1A 4210/4885KEAP1 2215/4885MEN1 3197/4885
US-20090124609-A1 Fused heterocyclic derivatives and methods of use HGF, HGFAC, MET DYRK1A 4826/4885KEAP1 417/4885MEN1 305/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.