SCHEMBL7669168

SCHEMBL7669168

C/C(=C/C(=O)O)c1ccc2c(c1)C(C)(C)CCCN2C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARA P10276 16/20 0.45
RARB P10826 15/20 0.45
RXRA P19793 13/20 0.43
RXRB P28702 4/20 0.43
RXRG P48443 3/20 0.43
RARG P13631 16/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
CYP26A1 O43174 1/20 0.43
GMNN O75496 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43
POLB P06746 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
NFKB1 P19838 1/20 0.43
CYP2C19 P33261 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
SCHEMBL7669171 1.00 RARA (0.45) RARARARBRXRARXRBRXRG
SCHEMBL7669165 1.00 RARA (0.45) RARARARBRXRARXRBRXRG
SCHEMBL7671024 0.93 RARA (0.52) RARARARBRXRARXRBRXRG
SCHEMBL7671033 0.93 RARA (0.52) RARARARBRXRARXRBRXRG
SCHEMBL7671029 0.93 RARA (0.52) RARARARBRXRARXRBRXRG
SCHEMBL7669337 0.87 RXRA (0.61) RARARARBRXRARXRBRXRG
SCHEMBL7669333 0.87 RXRA (0.61) RARARARBRXRARXRBRXRG
SCHEMBL7669186 0.84 RARB (0.50) RARARARBRXRARXRBRXRG
SCHEMBL7671229 0.84 RARA (0.43) RARARARBRXRARXRBRXRG
SCHEMBL7671233 0.84 RARA (0.43) RARARARBRXRARXRBRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6420363-B1 Mono- or polyenic carboxylic acid derivatives EISAI CO., LTD. (JP) 2002-07-16 US disclosed
US-6291508-B1 POTENT ABILITY TO BIND TO RETINOIC ACID RECEPTORS THUS USEFUL IN TREATING PSORIASIS AND RHEUMATOID ARTHRITIS. EISAI CO., LTD. (JP) 2001-09-18 US disclosed
US-6133283-A Mono- or polyenic carboxylic acid derivatives EISAI CO., LTD. (JP) 2000-10-17 US disclosed
US-6030964-A BINDS TO RETINOIC ACID RECEPTORS AND USEFUL FOR TREATING PSORIASIS, AUTOIMMUNE DISEASES, TUMORS, RHEUMATOID ARTHRITIS AND FOR INDUCING IMMUNOSUPPRESSION IN ORGAN TRANSPLANTATION EISAI CO., LTD. (JP) 2000-02-29 US disclosed
US-5977125-A Mono-or polyenic carboxylic acid derivatives EISAI CO., LTD. (JP) 1999-11-02 US disclosed
EP-0790228-A1 MONO- OR POLYENIC CARBOXYLIC ACID DERIVATIVE Eisai Co., Ltd. (JP) 1997-08-20 EP disclosed