SCHEMBL8460384

SCHEMBL8460384

COC(=O)c1ccc(N=Cc2ccc(OC)c(C34CC5CC(CC(C5)C3)C4)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARA P10276 4/20 0.55
RARB P10826 4/20 0.55
RARG P13631 4/20 0.55
HDAC11 Q96DB2 2/20 0.52
HDAC2 Q92769 1/20 0.52
CA1 P00915 4/20 0.51
CA2 P00918 4/20 0.51
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
NR1I2 O75469 1/20 0.49
LMNA P02545 1/20 0.49
PGR P06401 1/20 0.49
HSPD1 P10809 1/20 0.49
GOT1 P17174 1/20 0.49
GLRA1 P23415 1/20 0.49
BLM P54132 1/20 0.49

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
SCHEMBL9189893 1.00 RARA (0.55) RARARARBRARGHDAC11HDAC2
SCHEMBL9186030 0.91 RARA (0.67) RARARARBRARGHDAC11HDAC2
SCHEMBL9187408 0.91 RARA (0.67) RARARARBRARGHDAC11HDAC2
SCHEMBL8459692 0.88 RARA (0.49) RARARARBRARGHDAC11HDAC2
SCHEMBL9191306 0.83 RARA (0.55) RARARARBRARGHDAC11HDAC2
SCHEMBL566278 0.82 RARA (0.62) RARARARBRARGHDAC11HDAC2
SCHEMBL9079300 0.81 RARB (0.82) RARARARBRARGHDAC11HDAC2
SCHEMBL9079305 0.81 RARB (0.82) RARARARBRARGHDAC11HDAC2
SCHEMBL25200687 0.80 RARB (0.69) RARARARBRARGHDAC11HDAC2
SCHEMBL8459229 0.79 RARA (0.55) RARARARBRARGHDAC11HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5869067-A TREATING DERMATOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1999-02-09 US claimed
EP-0514269-B1 Imino-derivatives, process for their preparation and their use in human and veterinary medicine and in cosmetics CIRD GALDERMA (FR) 1995-11-02 EP claimed
US-5869067-A TREATING DERMATOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1999-02-09 US disclosed
US-5753239-A Bi-aromatic compounds and pharmaceutical and cosmetic compositions CENTRE INTERNATIONAL DE RECHERCHES DEMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1998-05-19 US disclosed