SCHEMBL7726552

SCHEMBL7726552

COc1ccc(-c2cc(C(N)=O)c(=O)n(CC3CCCC3)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
NPBWR1 P48145 1/20 0.47
CASP1 P29466 1/20 0.46
CRHR1 P34998 1/20 0.45
PARP15 Q460N3 1/20 0.43
PARP10 Q53GL7 1/20 0.43
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
BACE1 P56817 1/20 0.41
PTGIR P43119 1/20 0.41
SRC P12931 1/20 0.41
KCNH2 Q12809 1/20 0.41
PLA2G2A P14555 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
SCHEMBL7720077 0.96 CASP1 (0.48) NPC1RAB9ANPBWR1CASP1CRHR1
SCHEMBL7723459 0.88 CRHR1 (0.47) NPC1RAB9ANPBWR1CRHR1KMT2A
SCHEMBL7723511 0.87 MAPT (0.51) NPC1RAB9ANPBWR1CRHR1LMNA
SCHEMBL7725143 0.86 CRHR1 (0.46) NPC1RAB9ANPBWR1CRHR1KMT2A
SCHEMBL7724970 0.86 CRHR1 (0.49) NPC1RAB9ANPBWR1CRHR1KMT2A
SCHEMBL7725153 0.84 CRHR1 (0.47) NPC1RAB9ANPBWR1CRHR1KMT2A
SCHEMBL7723523 0.83 CRHR1 (0.51) NPC1RAB9ACRHR1LMNAL3MBTL1
SCHEMBL7724779 0.82 MAPT (0.53) NPC1RAB9ACRHR1LMNAL3MBTL1
SCHEMBL7724857 0.82 L3MBTL1 (0.50) NPC1RAB9AKMT2AL3MBTL1KDM4E
SCHEMBL7723691 0.81 CRHR1 (0.49) NPC1RAB9ACRHR1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6403586-B1 Pyridazine derivatives and drugs containing the same as the active ingredient KOWA CO., LTD. (JP) 2002-06-11 US disclosed
EP-1061077-A1 NOVEL PYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Kowa Co., Ltd. (JP) 2000-12-20 EP disclosed