SCHEMBL7019537

SCHEMBL7019537

CON(C)C(=O)c1ccc2c(c1)ncn2-c1ccnc(SC)n1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 4/20 0.41
HPGD P15428 7/20 0.39
GSK3B P49841 1/20 0.38
TSHR P16473 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LCK P06239 1/20 0.38
MKNK2 Q9HBH9 3/20 0.37
MKNK1 Q9BUB5 2/20 0.37
ALDH1A1 P00352 3/20 0.36
RAB9A P51151 2/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 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
SCHEMBL7020153 0.92 MAP3K14 (0.38) FGFR1LCKMKNK2MKNK1RAB9A
SCHEMBL7027073 0.84 FGFR1 (0.54) FGFR1HPGDTSHRNPSR1LCK
SCHEMBL7018074 0.77 LCK (0.65) LCKMKNK2MKNK1
SCHEMBL14561081 0.76 HPGD (0.36) HPGDTSHRALDH1A1MAPTLMNA
SCHEMBL7020443 0.75 FGFR1 (0.43) FGFR1LCKMKNK2MKNK1
SCHEMBL7014522 0.75 FGFR1 (0.54) FGFR1HPGDLCKMKNK2MKNK1
SCHEMBL7018051 0.74 LCK (0.55) FGFR1LCKALDH1A1MAPTLMNA
SCHEMBL7494174 0.74 ROCK1 (0.44) FGFR1LCKMKNK2MKNK1ALDH1A1
SCHEMBL6112685 0.74 HPGD (0.51) FGFR1HPGDALDH1A1RAB9AMAPT
SCHEMBL7552289 0.73 NPC1 (0.56) HPGDLCKMKNK2MKNK1ALDH1A1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1206265-B1 SRC KINASE INHIBITOR COMPOUNDS MERCK & CO INC (US) 2003-11-12 EP disclosed
US-6498165-B1 PYRIMIDINE COMPOUNDS; PROPHYLAXIS AND TREATMENT OF SUCH AS IMMUNE DISEASES, HYPERPROLIFERATIVE DISORDERS, CANCER, ANGIOGENSIS, ATHEROSCELEROSIS, GRAFT REJECTION, RHEUMATOID ARTHRITIS, PSORIASIS MERCK & CO., INC. 2002-12-24 US disclosed
EP-1206260-A4 SRC KINASE INHIBITOR COMPOUNDS MERCK & CO INC (US) 2002-10-30 EP disclosed
EP-1206265-A4 SRC KINASE INHIBITOR COMPOUNDS MERCK & CO INC (US) 2002-08-07 EP disclosed
EP-1206260-A1 SRC KINASE INHIBITOR COMPOUNDS Merck & Co., Inc. (US) 2002-05-22 EP disclosed
EP-1206265-A1 SRC KINASE INHIBITOR COMPOUNDS Merck & Co., Inc. (US) 2002-05-22 EP disclosed
US-6329380-B1 PYRIMIDINE BENZIMIDIZAZOLE, PYRIMIDINEIMIDAZOLE OR PYRIDINE IMIDAZOLE COMPOUNDS FOR ANTICANCER AGENTS OR ATHEROSCLEROSIS MERCK & CO., INC. 2001-12-11 US disclosed
WO-2001000207-A1 SRC KINASE INHIBITOR COMPOUNDS MERCK & CO., INC. (US) 2001-01-04 WO disclosed
WO-2001000213-A1 SRC KINASE INHIBITOR COMPOUNDS MERCK & CO., INC. (US) 2001-01-04 WO disclosed