SCHEMBL8501787

SCHEMBL8501787

Cc1ccc(CN[C]=O)s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 1/20 0.59
THRB P10828 3/20 0.49
TP53 P04637 2/20 0.49
ALDH1A1 P00352 4/20 0.44
LMNA P02545 1/20 0.44
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
EPHX2 P34913 1/20 0.41
KDM4C Q9H3R0 1/20 0.40
GAA P10253 3/20 0.40
MAPT P10636 3/20 0.40
ALOX15 P16050 2/20 0.40
ALOX12 P18054 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KDM4E B2RXH2 2/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL8501773 0.76 KDM4E (0.40) ALDH1A1LMNARAB9ASMN1; SMN2GAA
SCHEMBL21311972 0.72
SCHEMBL11050912 0.72
SCHEMBL2719762 0.71 PRMT6 (0.63) PRMT6THRBTP53ALDH1A1LMNA
SCHEMBL9971312 0.71 ALDH1A1 (0.58) PRMT6THRBTP53ALDH1A1NPC1
SCHEMBL23879711 0.69 PRMT6 (0.61) PRMT6THRBTP53ALDH1A1LMNA
SCHEMBL23432958 0.69 PRMT6 (0.61) PRMT6THRBTP53ALDH1A1LMNA
SCHEMBL4413504 0.69 PRMT6 (0.55) PRMT6THRBTP53ALDH1A1LMNA
SCHEMBL3306074 0.68 IKBKB (0.41) ALDH1A1RAB9AMEN1KMT2AGAA
SCHEMBL18355168 0.68 PRMT6 (0.59) PRMT6THRBTP53ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5939398-A ANTIATHEROSCLEROSIS AGENTS PFIZER INC. (US) 1999-08-17 US disclosed