SCHEMBL477127

SCHEMBL477127

O=C(O)Nc1cc(Br)ccn1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
SORT1 Q99523 6/20 0.52
NTRK1 P04629 1/20 0.52
RIOK2 Q9BVS4 1/20 0.51
NPC1 O15118 5/20 0.48
RAB9A P51151 5/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NR3C2 P08235 1/20 0.41
EGFR P00533 1/20 0.41
GRM5 P41594 1/20 0.40
ABL1 P00519 1/20 0.40
ACVRL1 P37023 1/20 0.40
TP53 P04637 1/20 0.40

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
SCHEMBL29899021 0.83 L3MBTL1 (0.55) SMN1; SMN2KDM4EALDH1A1SORT1NTRK1
SCHEMBL355579 0.83 L3MBTL1 (0.55) SMN1; SMN2KDM4EALDH1A1SORT1NTRK1
Ammonia Solution, Strong SCHEMBL28494689 0.81 L3MBTL1 (0.53) SMN1; SMN2KDM4EALDH1A1SORT1NTRK1
SCHEMBL16620629 0.81 NPC1 (0.61) ALDH1A1SORT1RIOK2NPC1RAB9A
SCHEMBL29899082 0.81 NPC1 (0.61) ALDH1A1SORT1RIOK2NPC1RAB9A
SCHEMBL16923772 0.80 JAK2 (0.51) SMN1; SMN2KDM4EALDH1A1SORT1NTRK1
SCHEMBL30185638 0.80 JAK2 (0.51) SMN1; SMN2KDM4EALDH1A1SORT1NTRK1
SCHEMBL17667096 0.80 ALDH1A1 (0.49) SMN1; SMN2KDM4EALDH1A1SORT1NTRK1
SCHEMBL17667094 0.80 ALDH1A1 (0.49) SMN1; SMN2KDM4EALDH1A1SORT1NTRK1
SCHEMBL25130745 0.79 RIOK2 (0.47) SMN1; SMN2KDM4EALDH1A1SORT1NTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228457-A1 AKT3 MODULATORS Georgiamune Inc. 2024-07-11 US disclosed
US-20240199603-A1 HPK1 ANTAGONISTS AND USES THEREOF SCHRÖDINGER, INC. 2024-06-20 US disclosed
WO-2024121427-A1 THERAPEUTIC COMPOUNDS SANOFI (FR) 2024-06-13 WO disclosed
US-12006316-B2 9H-pyrrolo-dipyridine derivatives UCB Biopharma SRL (BE) 2024-06-11 US disclosed
US-11993595-B2 Compounds MISSION THERAPEUTICS LIMITED (GB) 2024-05-28 US disclosed
WO-2024108009-A1 DYRK/CLK PROTACS AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2024-05-23 WO disclosed
EP-4371980-A1 AAK1 INHIBITOR AND USE THEREOF Xizang Haisco Pharmaceutical Co., Ltd. (CN) 2024-05-22 EP disclosed
EP-4359406-A1 CEREBLON BINDING COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH Celgene Corporation (US) 2024-05-01 EP disclosed
US-11926625-B2 HPK1 antagonists and uses thereof Nimbus Saturn, Inc. (US) 2024-03-12 US disclosed
WO-2024008909-A1 INHIBITORS OF CORONAVIRUS JANSSEN PHARMACEUTICA NV (BE) 2024-01-11 WO disclosed
WO-2009016286-A2 6-CYCLOAMINO-3-(PYRIDIN-4-YL)IMIDAZO[1,2-B]PYRIDAZINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2009-02-05 WO disclosed
US-20080193423-A1 Small organic molecule regulators of cell proliferation CURIS, INC. (US) 2008-08-14 US disclosed
US-20080194637-A1 Small organic molecule regulators of cell proliferation CURIS, INC. (US) 2008-08-14 US disclosed
US-20080182859-A1 tert-Butyl {4-[(4'-cyano-4-methoxy-biphenyl-3-ylmethyl)-amino]-cyclohexyl}-methyl-carbamate; hedgehog pathway agonists; to modulate proliferation or differentiation in a cell or tissue in vivo or vitro; alopecia; angiogenesis; wound healing; alzheimer's disease; to inhibit aging effects on skin CURIS, INC. (US) 2008-07-31 US disclosed
WO-2008057469-A1 SMALL ORGANIC MOLECULE REGULATORS OF CELL PROLIFERATION WYETH (US) 2008-05-15 WO disclosed
WO-2008057468-A1 SMALL ORGANIC MOLECULE REGULATORS OF CELL PROLIFERATION CURIS, INC. (US) 2008-05-15 WO disclosed
WO-2008057497-A2 SMALL ORGANIC MOLECULE REGULATORS OF CELL PROLIFERATION CURIS, INC. (US) 2008-05-15 WO disclosed
US-20080058521-A1 Processes for the preparation of compounds WYETH (US) 2008-03-06 US disclosed
WO-2007089669-A2 PROCESSES FOR THE PREPARATION OF COMPOUNDS WHICH MODULATE CELL PROLIFERATION WYETH (US) 2007-08-09 WO disclosed
WO-2005003123-A1 NOVEL PYRIDINE DERIVATIVES AS JNK SPECIFIC INHIBITORS ASTRAZENECA AB (SE) 2005-01-13 WO 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 (9 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-20080193423-A1 Small organic molecule regulators of cell proliferation GLI1, SHH, SMO SMN1; SMN2 3725/4885KDM4E 274/4885ALDH1A1 1638/4885
US-20080058521-A1 Processes for the preparation of compounds MKI67, MCL1, DCX SMN1; SMN2 1131/4885KDM4E 1883/4885ALDH1A1 1315/4885
US-20240199603-A1 HPK1 ANTAGONISTS AND USES THEREOF PDXK, HIPK1, PCK1 SMN1; SMN2 3277/4885KDM4E 3143/4885ALDH1A1 4740/4885
US-20080194637-A1 Small organic molecule regulators of cell proliferation GLI1, SHH, SMO SMN1; SMN2 3725/4885KDM4E 274/4885ALDH1A1 1638/4885
US-20240228457-A1 AKT3 MODULATORS AKT3, AKT2, PIK3CA SMN1; SMN2 2352/4885KDM4E 4303/4885ALDH1A1 4168/4885
US-12006316-B2 9H-pyrrolo-dipyridine derivatives MAPT, PSEN1, PRNP SMN1; SMN2 592/4885KDM4E 1968/4885ALDH1A1 3567/4885
US-11993595-B2 Compounds UCHL1, UCHL3, UCHL5 SMN1; SMN2 3529/4885KDM4E 175/4885ALDH1A1 300/4885
US-20080182859-A1 tert-Butyl {4-[(4'-cyano-4-methoxy-biphenyl-3-ylmethyl)-amino]-cyclohexyl}-methyl-carbamate; hedgehog pathway agonists; to modulate proliferation or differentiation in a cell or tissue in vivo or vitro; alopecia; angiogenesis; wound healing; alzheimer's disease; to inhibit aging effects on skin SHH, GLI1, SMO SMN1; SMN2 2898/4885KDM4E 52/4885ALDH1A1 2463/4885
US-11926625-B2 HPK1 antagonists and uses thereof PDXK, HIPK1, PCK1 SMN1; SMN2 3277/4885KDM4E 3143/4885ALDH1A1 4740/4885

“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.