SCHEMBL9822473

SCHEMBL9822473

CCNS(=O)(=O)c1ccc(/C=C/C(=O)c2ccc3c(c2)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 5/20 0.53
RARA P10276 6/20 0.48
RARB P10826 6/20 0.48
RARG P13631 6/20 0.48
RXRA P19793 2/20 0.43
LMNA P02545 2/20 0.43
CYP3A4 P08684 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
GMNN O75496 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43
POLB P06746 1/20 0.43
CYP2D6 P10635 1/20 0.43
NFKB1 P19838 1/20 0.43
CYP2C19 P33261 1/20 0.43
THPO P40225 1/20 0.43
MTOR P42345 1/20 0.43

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
SCHEMBL9822477 1.00 CYP26A1 (0.53) CYP26A1RARARARBRARGRXRA
SCHEMBL9822432 0.85 CYP26A1 (0.60) CYP26A1RARARARBRARGRXRA
SCHEMBL9822438 0.85 CYP26A1 (0.60) CYP26A1RARARARBRARGRXRA
SCHEMBL9822475 0.83 CYP26A1 (0.58) CYP26A1RARARARBRARGRXRA
SCHEMBL9822558 0.83 RXRA (0.59) CYP26A1RARARARBRARGRXRA
SCHEMBL7545408 0.83 RARG (0.62) CYP26A1RARARARBRARGRXRA
SCHEMBL7088904 0.83 RARG (0.62) CYP26A1RARARARBRARGRXRA
SCHEMBL9822716 0.80 CYP26A1 (0.48) CYP26A1RARARARBRARGLMNA
SCHEMBL9822702 0.80 CYP26A1 (0.48) CYP26A1RARARARBRARGLMNA
SCHEMBL17302425 0.79 CYP26A1 (0.64) CYP26A1RARARARBRARGRXRA

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-0297995-B1 POLYCYCLIC AROMATIC COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE IN HUMAN AND ANIMAL MEDICINE AND IN COSMETICS L'OREAL (FR) 1991-03-06 EP claimed