SCHEMBL7420122

SCHEMBL7420122

COCCc1nc2c[nH]nc2c(=O)[nH]1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CACNA1H O95180 1/20 0.37
▸ PDE10A Q9Y233 1/20 0.36
▸ LMNA P02545 2/20 0.36
▸ PARP1 P09874 2/20 0.35
▸ KDM4C Q9H3R0 1/20 0.35
▸ ADORA3 P0DMS8 3/20 0.34
▸ KDM4E B2RXH2 4/20 0.34
▸ POLB P06746 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ PKM P14618 2/20 0.33
▸ PARP2 Q9UGN5 1/20 0.33
▸ TNKS2 Q9H2K2 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ HCAR2 Q8TDS4 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ PABPC1 P11940 1/20 0.31
▸ ADORA2A P29274 1/20 0.31

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
SCHEMBL7379913 0.81 TNKS2 (0.50) PDE10APARP1KDM4CADORA3KDM4E
SCHEMBL22118823 0.78 KDM4E (0.42) PDE10ALMNAADORA3KDM4EALDH1A1
SCHEMBL7422513 0.77 ADORA3 (0.33) ADORA3KDM4ETNKS2GAA
SCHEMBL22118927 0.75 ADORA3 (0.33) ADORA3KDM4EPKMTNKS2GAA
SCHEMBL7416792 0.75 KDM4E (0.32) PDE10APARP1KDM4CKDM4EALDH1A1
SCHEMBL18632642 0.75 PARP1 (0.38) CACNA1HPDE10ALMNAPARP1KDM4C
SCHEMBL14281548 0.72 PARP1 (0.46) LMNAPARP1ADORA3KDM4EALDH1A1
SCHEMBL22119325 0.70 CYP1A2 (0.32) KDM4ECYP1A2CYP2C19
SCHEMBL22118787 0.69 USP2 (0.30) BLMHSD17B10
SCHEMBL6920370 0.69 NPC1 (0.46) PDE10ALMNAPARP1KDM4CKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1220856-A2 PYRAZOLO[4,3-D]PYRIMIDINE DERIVATIVES Pfizer Limited (GB) 2002-07-10 — — EP claimed
WO-2001027113-A2 PYRAZOLO `4,3-d! PYRIMIDINE DERIVATIVES PFIZER LIMITED (GB) 2001-04-19 — — WO claimed
EP-1220856-A2 PYRAZOLO[4,3-D]PYRIMIDINE DERIVATIVES Pfizer Limited (GB) 2002-07-10 — — EP disclosed
WO-2001027113-A2 PYRAZOLO `4,3-d! PYRIMIDINE DERIVATIVES PFIZER LIMITED (GB) 2001-04-19 — — WO disclosed
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