SCHEMBL6996535

SCHEMBL6996535

CON(C)C(=O)Oc1sc(SC)c2c1CCc1sc(-c3ccccc3)nc1-2

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
PTGDR2 Q9Y5Y4 3/20 0.33
CCNC P24863 3/20 0.33
CDK8 P49336 3/20 0.33
CDK19 Q9BWU1 3/20 0.33
TRPM8 Q7Z2W7 2/20 0.32
KDM4E B2RXH2 2/20 0.32
ALOX5 P09917 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
RARA P10276 1/20 0.32
RARB P10826 1/20 0.32
RARG P13631 1/20 0.32
POLB P06746 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
SCHEMBL6989475 0.86 TRPM8 (0.41) MEN1KMT2APTGDR2CCNCCDK8
SCHEMBL6990917 0.81 NPC1 (0.41) MEN1KMT2APTGDR2CCNCCDK8
SCHEMBL6992723 0.79 CCNC (0.49) PTGDR2CCNCCDK8CDK19KDM4E
SCHEMBL6997444 0.78 EPHX1 (0.43) MEN1KMT2AKDM4EALOX5ALDH1A1
SCHEMBL6988288 0.77 CCNC (0.39) MEN1KMT2ACCNCCDK8CDK19
SCHEMBL6988867 0.76 ALDH1A1 (0.51) CCNCCDK8CDK19KDM4EALDH1A1
SCHEMBL6987226 0.75 CDC7 (0.53) MEN1KMT2ATRPM8KDM4EALDH1A1
SCHEMBL6990002 0.74 NPC1 (0.53) MEN1KMT2APTGDR2CCNCCDK8
SCHEMBL7090942 0.74 ALDH1A1 (0.49) MEN1KMT2AALDH1A1MAPTNPC1
SCHEMBL8319767 0.72 TSHR (0.46) MEN1KMT2ACCNCCDK8CDK19

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
EP-0931074-B1 CONDENSED 4,5,6,7-TETRAHYDROBENZO C]THIOPHENES AS ENHANCER FOR CELL DIFFERENTIATION INDUCTION FACTOR ACTION TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-05-07 EP claimed