SCHEMBL7455986

SCHEMBL7455986

O=Cc1nc(Cc2ccccc2)c[nH]1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
FEN1 P39748 1/20 0.38
CALM1 P0DP23 1/20 0.38
BRD4 O60885 1/20 0.37
TAAR1 Q96RJ0 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HRH3 Q9Y5N1 1/20 0.37
PNP P00491 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
HPGD P15428 2/20 0.36
KDM4E B2RXH2 1/20 0.36
BCAT2 O15382 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
ELANE P08246 1/20 0.36
LTB4R Q15722 1/20 0.35
GAA P10253 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
SCHEMBL29951252 0.86 KCNH2 (0.47) TAAR1MAPT
SCHEMBL26225864 0.84 HRH4 (0.40) POLBALDH1A1HRH3PNPHPGD
SCHEMBL10875259 0.84 L3MBTL1 (0.37) POLBCALM1BRD4TAAR1ALDH1A1
SCHEMBL16653784 0.83 HDAC1 (0.43) HRH3MAPT
SCHEMBL7349350 0.82 TSHR (0.46) HRH3ADORA2AADORA1HPGDKDM4E
SCHEMBL9020936 0.76 TAAR1 (0.36) POLBBRD4TAAR1ALDH1A1HRH3
SCHEMBL1723556 0.76 TAAR1 (0.48) POLBCALM1TAAR1ALDH1A1HRH3
SCHEMBL11291277 0.76 ADORA2A (0.36) POLBBRD4TAAR1ALDH1A1HRH3
SCHEMBL6626882 0.74 CALM1 (0.41) POLBCALM1BRD4TAAR1ALDH1A1
SCHEMBL4743172 0.74 CALM1 (0.41) POLBFEN1CALM1BRD4TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118005563-A N-benzyl imidazole derivative and preparation method and application thereof 中国药科大学 2024-05-10 CN claimed
EP-0891360-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2002-05-15 EP disclosed
US-6316436-B1 ANTICANCER AGENTS MERCK & CO., INC. 2001-11-13 US disclosed
WO-2000034239-A2 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2000-06-15 WO disclosed
US-6001835-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-12-14 US disclosed
EP-0891360-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-01-20 EP disclosed
WO-1997036900-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-09 WO disclosed
EP-0125783-A1 Dopamine-beta-hydroxylase inhibitors SMITHKLINE BECKMAN CORPORATION (US) 1984-11-21 EP disclosed