SCHEMBL10353432

SCHEMBL10353432

COc1ccc(-c2cnccn2)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FYN P06241 4/20 0.49
▸ NPY5R Q15761 1/20 0.49
▸ KDM4E B2RXH2 4/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ HSD17B10 Q99714 2/20 0.49
▸ CCNB2 O95067 1/20 0.49
▸ CDK1 P06493 1/20 0.49
▸ CCNB1 P14635 1/20 0.49
▸ GSK3A P49840 1/20 0.49
▸ GSK3B P49841 1/20 0.49
▸ CDK5 Q00535 1/20 0.49
▸ CDK5R1 Q15078 1/20 0.49
▸ CCNB3 Q8WWL7 1/20 0.49
▸ KLK3 P07288 1/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ MAPT P10636 1/20 0.48
▸ CYP2D6 P10635 1/20 0.47
▸ CYP19A1 P11511 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47

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
SCHEMBL30336594 1.00 FYN (0.49) FYNNPY5RKDM4EMAPK1HSD17B10
SCHEMBL16385234 0.87 RAB9A (0.53) KDM4ECCNB2CDK1CCNB1GSK3A
SCHEMBL30017937 0.85 KDM1A (0.50) FYNKDM4EMEN1KMT2ACYP2D6
SCHEMBL30017655 0.85 ALDH1A1 (0.51) KDM4EMAPK1MEN1KMT2AMAPT
SCHEMBL23033309 0.83 GHSR (0.44) KDM4EMAPK1CCNB2CDK1CCNB1
SCHEMBL29950627 0.82 PDCD1 (0.49) FYNKLK3CYP2D6CYP19A1CYP2C9
SCHEMBL23703299 0.82 PDCD1 (0.49) FYNKLK3CYP2D6CYP19A1CYP2C9
SCHEMBL29321962 0.79 MKNK1 (0.49) KDM4EHSD17B10KLK3MEN1KMT2A
SCHEMBL5797361 0.77 MEN1 (0.56) KDM4EMAPK1HSD17B10MEN1KMT2A
SCHEMBL29496946 0.77 MEN1 (0.56) KDM4EMAPK1HSD17B10MEN1KMT2A

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
EP-0204172-B1 PHENYLPYRAZINE DERIVATIVES, PROCESSES FOR PREPARING THEM, PHARMACEUTICAL COMPOSITION AND USE SUNTORY LIMITED (JP) 1990-09-19 — — EP claimed
CN-106604920-A Pyridone derivatives with tetrahydropyranylmethyl groups 第三共株式会社 2017-04-26 — — CN disclosed
EP-0204172-B1 PHENYLPYRAZINE DERIVATIVES, PROCESSES FOR PREPARING THEM, PHARMACEUTICAL COMPOSITION AND USE SUNTORY LIMITED (JP) 1990-09-19 — — EP disclosed
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