SCHEMBL8535608

SCHEMBL8535608

Cn1nc(N)c2ccccc2c1=O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
TBXAS1 P24557 1/20 0.47
KAT2B Q92831 5/20 0.46
ALDH1A1 P00352 2/20 0.46
HSD17B10 Q99714 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
POLB P06746 1/20 0.45
PKM P14618 1/20 0.45
CDK8 P49336 1/20 0.45
ACVR1 Q04771 1/20 0.45
ENPP1 P22413 1/20 0.44

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
SCHEMBL434996 0.78 NPSR1 (0.58) HPGDMEN1KMT2ATBXAS1ALDH1A1
SCHEMBL29059152 0.77 KAT2B (0.47) HPGDKAT2BSMN1; SMN2CDK8ACVR1
SCHEMBL19869863 0.76 MEN1 (0.47) HPGDMEN1KMT2ATBXAS1KAT2B
SCHEMBL1333571 0.76 HPGD (0.55) HPGDMEN1KMT2ATBXAS1KAT2B
SCHEMBL17559135 0.76 KAT2B (0.50) HPGDMEN1KMT2ATBXAS1KAT2B
SCHEMBL31091769 0.76 KAT2B (0.50) HPGDMEN1KMT2ATBXAS1KAT2B
SCHEMBL8864626 0.75 HPGD (0.67) HPGDMEN1KMT2ATBXAS1ALDH1A1
SCHEMBL823488 0.75 GSK3B (0.45) HPGDALDH1A1HSD17B10
SCHEMBL13145736 0.73 HPGD (0.45) HPGDMEN1KMT2ATBXAS1KAT2B
SCHEMBL12203808 0.73 SMN1; SMN2 (0.61) MEN1KMT2AALDH1A1SMN1; SMN2POLB

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-5719155-A CARDIOVASCULAR DISORDERS JAPAN TOBACCO INC. (JP) 1998-02-17 US disclosed
EP-0677519-A1 CHROMAN DERIVATIVE AND MEDICINAL USE THEREOF Japan Tobacco Inc. (JP) 1995-10-18 EP disclosed