SCHEMBL12924339

SCHEMBL12924339

CCCCCCCc1cc2c(s1)-c1ccc3c4c(ccc-2c14)-c1sc(-c2ccc(C)cc2)cc1-3

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 1/20 0.32
▸ MAPK14 Q16539 1/20 0.32
▸ MAPT P10636 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ GCGR P47871 1/20 0.30
▸ ESR1 P03372 1/20 0.30
▸ ESR2 Q92731 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
SCHEMBL12924376 0.99 MAPK14 (0.32) RARBMAPK14MAPTTHRBBLM
SCHEMBL12924284 0.87 MAPK14 (0.30) MAPK14
SCHEMBL12924378 0.87 MAPK14 (0.30) MAPK14
SCHEMBL12924328 0.84 HSD17B1 (0.35) MAPTESR1
SCHEMBL12924340 0.84 HSD17B1 (0.35) MAPTESR1
SCHEMBL12924298 0.81 ESR1 (0.42) MAPTESR1ESR2
SCHEMBL12924307 0.81 ESR1 (0.42) MAPTESR1ESR2
SCHEMBL12924299 0.80 LMNA (0.40) MAPK14MAPT
SCHEMBL12924296 0.78 RARB (0.39) RARBESR1ESR2
SCHEMBL12924312 0.78 RARB (0.39) RARBESR1ESR2

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-20110012098-A1 ORGANIC TRANSISTOR YAMAMOTO CHEMICALS, INC. (JP) 2011-01-20 — — US disclosed
Send feedback