SCHEMBL8911209

SCHEMBL8911209

COc1cc(C23CC4CC(CC(C4)C2)C3)cc(-c2cccc3ccccc23)c1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARA P10276 2/20 0.41
RARB P10826 2/20 0.41
RARG P13631 2/20 0.41
LMNA P02545 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
NR1I2 O75469 1/20 0.41
PGR P06401 1/20 0.41
HSPD1 P10809 1/20 0.41
GOT1 P17174 1/20 0.41
GLRA1 P23415 1/20 0.41
BLM P54132 1/20 0.41
HSPE1 P61604 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
AVPR2 P30518 2/20 0.40
AVPR1A P37288 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SLC37A4 O43826 1/20 0.39
KDM4E B2RXH2 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
SCHEMBL8909355 0.84 MEN1 (0.42) RARARARBRARGKMT2AMEN1
SCHEMBL8458292 0.75 IKBKB (0.41) RARALMNAKMT2ACNR2GPR55
SCHEMBL8458293 0.72 IKBKB (0.39) RARAKMT2AMEN1NPC1RAB9A
SCHEMBL8458442 0.72 IKBKB (0.42) RARALMNAKMT2AMEN1AVPR2
SCHEMBL8459014 0.71 CNR2 (0.31) AVPR2AVPR1ACNR2
SCHEMBL21194961 0.69 GPR35 (0.43) RARARARBRARGLMNAKMT2A
SCHEMBL17323573 0.67 MEN1 (0.45) RARARARBRARGLMNAKMT2A
SCHEMBL4747624 0.67 RARB (0.61) RARARARBRARGLMNAKMT2A
SCHEMBL3715625 0.67 KMT2A (0.61) RARARARBRARGLMNAKMT2A
SCHEMBL1082729 0.67 KMT2A (0.61) RARARARBRARGLMNAKMT2A

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-5686586-A Polycyclic aromatic derivatives, process for preparing the same and pharmaceutical and cosmetic compositions containing the same CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1997-11-11 US disclosed