SCHEMBL92331

SCHEMBL92331

O=C1CNCCN1Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.56
SIGMAR1 Q99720 2/20 0.55
DDB1 Q16531 1/20 0.51
CRBN Q96SW2 1/20 0.51
GSK3A P49840 1/20 0.50
GSK3B P49841 1/20 0.50
KMT2A Q03164 3/20 0.46
CYP2C9 P11712 3/20 0.46
CYP2C19 P33261 3/20 0.46
MEN1 O00255 2/20 0.46
POLB P06746 1/20 0.46
CYP2D6 P10635 1/20 0.46
TSHR P16473 2/20 0.45
HPGD P15428 1/20 0.45
GAA P10253 1/20 0.45
EPHX2 P34913 1/20 0.44
MAPT P10636 1/20 0.44
HTR6 P50406 2/20 0.44
ALDH1A1 P00352 1/20 0.42
HIF1A Q16665 1/20 0.42

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
Bromide SCHEMBL28426487 0.98 L3MBTL1 (0.54) L3MBTL1SIGMAR1DDB1CRBNGSK3A
Hydrochloric Acid SCHEMBL4768580 0.98 L3MBTL1 (0.54) L3MBTL1SIGMAR1DDB1CRBNGSK3A
SCHEMBL10765650 0.92 L3MBTL1 (0.59) L3MBTL1SIGMAR1DDB1CRBNGSK3A
SCHEMBL7996202 0.90 ENPP2 (0.51) L3MBTL1SIGMAR1DDB1CRBNGSK3A
Trifluoroacetic Acid SCHEMBL28701154 0.88 L3MBTL1 (0.46) L3MBTL1SIGMAR1DDB1CRBNGSK3A
SCHEMBL7265760 0.88 DDB1 (0.48) L3MBTL1SIGMAR1DDB1CRBNGSK3A
SCHEMBL931348 0.85 SIGMAR1 (0.49) L3MBTL1SIGMAR1GSK3AGSK3BKMT2A
Tert-Butyl Formate SCHEMBL27800995 0.85 L3MBTL1 (0.43) L3MBTL1SIGMAR1DDB1CRBNGSK3A
SCHEMBL4694508 0.84 CYP2C9 (0.67) SIGMAR1KMT2ACYP2C9CYP2C19MEN1
SCHEMBL4692001 0.84 MEN1 (0.47) L3MBTL1SIGMAR1KMT2ACYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025101892-A1 POLY-ADP RIBOSE POLYMERASE (PARP) INHIBITORS AND USES THEREOF Astellas Engineered Small Molecules US, Incorporated (US) 2025-05-15 WO disclosed
CN-114163437-B Substituted pyrazolo [1,5-a ] pyridine compounds as RET kinase inhibitors 阿雷生物药品公司 2025-03-04 CN disclosed
CN-115103841-B Substituted quinolinone piperazine compounds useful as T cell activators 百时美施贵宝公司 2024-12-27 CN disclosed
EP-4081513-B1 SUBSTITUTED QUINOLINONYL PIPERAZINE COMPOUNDS USEFUL AS T CELL ACTIVATORS BRISTOL MYERS SQUIBB CO (US) 2024-11-20 EP disclosed
US-12059420-B2 Inhibitors of indoleamine 2,3-dioxygenase and methods of their use BRISTOL-MYERS SQUIBB COMPANY (US) 2024-08-13 US disclosed
US-11998545-B2 Substituted pyrazolo[1,5-a]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2024-06-04 US disclosed
US-20240083857-A1 2-Methyl-Quinazolines Bayer Pharma AG (DE) 2024-03-14 US disclosed
US-20240067631-A1 PYRAZOLE DERIVATIVES USEFUL AS NAMPT MODULATORS CYTOKINETICS, INC. 2024-02-29 US disclosed
US-20240066029-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2024-02-29 US disclosed
US-11912708-B2 Macrocyclic heterocycles and uses thereof KUMQUAT BIOSCIENCES INC. (US) 2024-02-27 US disclosed
WO-2000001702-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2000-01-13 WO disclosed
WO-1998056771-A2 PIPERAZINE DERIVATIVES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 1998-12-17 WO disclosed
EP-0444156-A4 METHOD FOR TREATING VASCULAR DISEASES 1992-12-09 EP disclosed
US-5164388-A Hypotensive agents, treatment of congestive heart failure ABBOTT LABORATORIES (US) 1992-11-17 US disclosed
EP-0439556-A4 HETEROCYCLIC PEPTIDE RENIN INHIBITORS 1991-10-30 EP disclosed
EP-0444156-A1 METHOD FOR TREATING VASCULAR DISEASES ABBOTT LABORATORIES (US) 1991-09-04 EP disclosed
EP-0439556-A1 HETEROCYCLIC PEPTIDE RENIN INHIBITORS ABBOTT LABORATORIES (US) 1991-08-07 EP disclosed
WO-1990005531-A1 METHOD FOR TREATING VASCULAR DISEASES ABBOTT LABORATORIES (US) 1990-05-31 WO disclosed
WO-1990004917-A1 HETEROCYCLIC PEPTIDE RENIN INHIBITORS ABBOTT LABORATORIES (US) 1990-05-17 WO disclosed
EP-0365992-A1 Heterocyclic peptide renin inhibitors ABBOTT LABORATORIES (US) 1990-05-02 EP 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 (6 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-20240083857-A1 2-Methyl-Quinazolines NRAS, KRAS, KSR2 L3MBTL1 4526/4885SIGMAR1 2744/4885DDB1 1817/4885
US-11912708-B2 Macrocyclic heterocycles and uses thereof HRAS, KRAS, TP53 L3MBTL1 2631/4885SIGMAR1 3391/4885DDB1 611/4885
US-12059420-B2 Inhibitors of indoleamine 2,3-dioxygenase and methods of their use IDO1, IDO2, INMT L3MBTL1 4549/4885SIGMAR1 3382/4885DDB1 1894/4885
US-20240067631-A1 PYRAZOLE DERIVATIVES USEFUL AS NAMPT MODULATORS NAMPT, NNT, NAPRT L3MBTL1 3352/4885SIGMAR1 2794/4885DDB1 4756/4885
US-11998545-B2 Substituted pyrazolo[1,5-a]pyridine compounds as RET kinase inhibitors RET, ROR1, BRAF L3MBTL1 1445/4885SIGMAR1 3863/4885DDB1 1519/4885
US-20240066029-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF L3MBTL1 1445/4885SIGMAR1 3863/4885DDB1 1519/4885

“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.