SCHEMBL4803099

SCHEMBL4803099

CC1(C)CC=C(c2ccccc2)c2cc(CNc3ccc(C(=O)O)cc3F)ccc21

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RARA P10276 18/20 0.56
RARB P10826 18/20 0.56
RARG P13631 16/20 0.56
RXRA P19793 1/20 0.56
NR2E1 Q9Y466 1/20 0.56

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
SCHEMBL4797695 0.90 RARB (0.57) RARARARBRARGRXRANR2E1
SCHEMBL4652247 0.83 RARA (0.73) RARARARBRARGRXRANR2E1
SCHEMBL8771650 0.80 RARB (0.77) RARARARBRARGRXRANR2E1
SCHEMBL18868819 0.80 RARB (0.70) RARARARBRARGRXRANR2E1
SCHEMBL8843431 0.76 RARA (0.63) RARARARBRARGRXRANR2E1
SCHEMBL4652302 0.75 RARB (0.74) RARARARBRARGRXRANR2E1
SCHEMBL27445326 0.74 RARB (0.64) RARARARBRARGRXRANR2E1
SCHEMBL8771659 0.74 RARA (0.59) RARARARBRARGRXRANR2E1
SCHEMBL8771749 0.73 RARB (0.56) RARARARBRARGRXRANR2E1
SCHEMBL1711030 0.73 HDAC8 (0.59)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1604647-B1 Cosmetic composition containing polyorganosiloxane-containing epsilon-polylysine polymer, and polyhydric alcohol, and production thereof CHISSO CORP (JP) 2008-05-07 EP disclosed
EP-1604647-A1 Cosmetic composition containing polyorganosiloxane-containing epsilon-polylysine polymer, and polyhydric alcohol, and production thereof Ichimaru Pharcos Co., Ltd. (JP) 2005-12-14 EP disclosed