SCHEMBL7675684

SCHEMBL7675684

C/C(=C/C(=O)O)c1ccc2c(c1)N(C(C)C)CCC2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARA P10276 2/20 0.38
RARB P10826 2/20 0.38
RARG P13631 2/20 0.38
LMNA P02545 3/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
ALDH1A1 P00352 2/20 0.37
NR4A1 P22736 1/20 0.37
NR4A2 P43354 1/20 0.37
NR4A3 Q92570 1/20 0.37
ACHE P22303 1/20 0.36
NOTUM Q6P988 1/20 0.36
HPGD P15428 1/20 0.36
PMP22 Q01453 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL7675680 1.00 RARA (0.38) RARARARBRARGLMNATP53
SCHEMBL7675685 1.00 RARA (0.38) RARARARBRARGLMNATP53
SCHEMBL7675776 0.90 HDAC1 (0.44) RARARARBRARGLMNATP53
SCHEMBL7675774 0.90 HDAC1 (0.44) RARARARBRARGLMNATP53
SCHEMBL7675768 0.90 HDAC1 (0.44) RARARARBRARGLMNATP53
SCHEMBL7664713 0.87 RXRA (0.51) RARARARBRARGALDH1A1
SCHEMBL7664723 0.87 RXRA (0.51) RARARARBRARGALDH1A1
SCHEMBL20178668 0.85 ALDH1A1 (0.51) RARARARBRARGLMNATP53
SCHEMBL7666880 0.83 NR4A1 (0.41) RARARARBRARGNR4A1NR4A2
SCHEMBL7666875 0.83 NR4A1 (0.41) RARARARBRARGNR4A1NR4A2

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