SCHEMBL15049801

SCHEMBL15049801

Cc1cc(CN[SH](=O)=O)cc2c1C(c1ccc(F)cc1)=CC(C)(C)O2

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RARA P10276 2/20 0.31
RARB P10826 2/20 0.31
RARG P13631 2/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL14670456 0.81 RARA (0.34) RARARARBRARGMEN1ALDH1A1
SCHEMBL15049702 0.80 MEN1 (0.30) MEN1ALDH1A1KMT2A
SCHEMBL15049811 0.76 NR3C2 (0.31)
SCHEMBL3017143 0.76 NR3C2 (0.43) MEN1ALDH1A1KMT2A
SCHEMBL3032572 0.75 RARA (0.35) RARARARBRARGMEN1ALDH1A1
SCHEMBL14670426 0.73 RARA (0.32) RARARARBRARGMEN1ALDH1A1
SCHEMBL13234998 0.73 RARA (0.33) RARARARBRARG
SCHEMBL14670458 0.71 BRD4 (0.32) RARARARBRARG
SCHEMBL15062298 0.71 MGAM (0.33) RARARARBRARGALDH1A1
SCHEMBL15049809 0.70

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-2179994-B1 FUSED BICYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2013-06-26 EP claimed