SCHEMBL7918121

SCHEMBL7918121

O=c1[nH]nc(Cc2cccnc2)c2ccc(Cl)cc12

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.56
PARP1 P09874 6/20 0.53
HTT P42858 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
AR P10275 4/20 0.51
PRMT5 O14744 2/20 0.49
WDR77 Q9BQA1 2/20 0.49
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KMT2A Q03164 3/20 0.45
PKM P14618 1/20 0.45
OPRM1 P35372 1/20 0.45
OPRD1 P41143 1/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
FLT1 P17948 1/20 0.45
PLA2G7 Q13093 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
SCHEMBL7914591 0.96 LMNA (0.58) LMNAPARP1HTTNPSR1AR
SCHEMBL4697283 0.85 PARP1 (0.53) LMNAPARP1ARPRMT5WDR77
SCHEMBL16110172 0.85 PARP1 (0.53) LMNAPARP1ARPRMT5WDR77
SCHEMBL12955389 0.84 AR (0.72) LMNAPARP1ARPRMT5
SCHEMBL16110564 0.81 PRMT5 (0.53) LMNAPARP1ARPRMT5WDR77
SCHEMBL4701154 0.79 RAB9A (0.57) LMNAPARP1HTTALDH1A1KMT2A
SCHEMBL4697231 0.78 PARP1 (0.53) LMNAPARP1HTTALDH1A1SMN1; SMN2
SCHEMBL4698713 0.77 PARP1 (0.66) PARP1ALDH1A1SMN1; SMN2
SCHEMBL4702128 0.77 MEN1 (0.55) LMNAPARP1HTTALDH1A1KMT2A
SCHEMBL8527636 0.76 FLT1 (0.57) NPSR1KMT2APKMOPRM1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6218392-B1 FOR THERAPY AND PROPHYLAXIS OF ISCHEMIC HEART DISEASES SUCH AS ANGINA PECTORIS, MYOCARDIAL INFARCT AND CHRONIC AND ACUTE CARDIAC FAILURE, PULMONARY HYPERTENSION, ARTERIOSCLEROSIS AND BRONCHIAL ASTHMA EISAI CO., LTD. (JP) 2001-04-17 US disclosed
US-5849741-A Fused pyridazine compounds EISAI CO., LTD. (JP) 1998-12-15 US disclosed
EP-0722936-A1 FUSED PYRIDAZINE COMPOUND Eisai Co., Ltd. (JP) 1996-07-24 EP disclosed