SCHEMBL7416792

SCHEMBL7416792

CN(CCc1nc2c[nH]nc2c(=O)[nH]1)S(C)(=O)=O

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ PDE10A Q9Y233 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ PIM1 P11309 1/20 0.32
▸ PIM2 Q9P1W9 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ PARP1 P09874 1/20 0.32
▸ KDM4C Q9H3R0 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL7420122 0.75 CACNA1H (0.37) KDM4ECYP1A2HSD17B10PDE10AALDH1A1
SCHEMBL7379913 0.74 TNKS2 (0.50) KDM4EPDE10AALDH1A1SMN1; SMN2PARP1
SCHEMBL22118823 0.71 KDM4E (0.42) KDM4ECYP1A2HSD17B10PDE10AALDH1A1
SCHEMBL7422513 0.68 ADORA3 (0.33) KDM4E
SCHEMBL22118811 0.68 — —
SCHEMBL22118927 0.67 ADORA3 (0.33) KDM4EMEN1KMT2A
SCHEMBL14281548 0.66 PARP1 (0.46) KDM4ECYP1A2HSD17B10ALDH1A1SMN1; SMN2
SCHEMBL22119325 0.64 CYP1A2 (0.32) KDM4ECYP1A2CYP2C9CYP2C19
SCHEMBL19236511 0.63 MITF (0.47) KDM4EHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL7350550 0.62 KMT2A (0.40) KDM4CKMT2A

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
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
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