SCHEMBL7622797

SCHEMBL7622797

COC(=O)c1ccc(C(=O)c2cc3c(cc2N)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXRA P19793 15/20 0.55
RXRB P28702 4/20 0.53
RXRG P48443 4/20 0.53
RARB P10826 3/20 0.53
RARG P13631 3/20 0.53
RARA P10276 2/20 0.53
CYP3A4 P08684 3/20 0.52
HNF4A P41235 3/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
GLA P06280 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
CASP1 P29466 1/20 0.50
CASP7 P55210 1/20 0.50
ATM Q13315 1/20 0.50
HSD17B10 Q99714 1/20 0.50
CYP26A1 O43174 2/20 0.48

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
SCHEMBL3982018 0.86 RXRA (0.72) RXRARXRBRXRGRARBRARG
SCHEMBL6915712 0.85 RXRA (0.72) RXRARXRBRXRGRARBRARG
SCHEMBL24055013 0.82 RXRA (0.65) RXRARXRBRXRGRARBRARG
SCHEMBL24055303 0.82 RXRA (0.53) RXRARXRBRXRGRARBRARG
SCHEMBL24055408 0.81 RXRA (0.58) RXRARXRBRXRGRARBRARG
SCHEMBL24055304 0.81 RXRA (0.58) RXRARXRBRXRGRARBRARG
SCHEMBL7616381 0.81 RXRA (0.52) RXRARXRBRXRGRARBRARG
SCHEMBL7422927 0.80 RXRA (0.70) RXRARXRBRXRGRARBRARG
SCHEMBL24055312 0.80 RXRA (0.67) RXRARXRBRXRGRARBRARG
SCHEMBL6914131 0.80 RXRA (0.76) RXRARXRBRXRGRARBRARG

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-6476017-B2 (DIBENZO(B,E)(1,4)-DIAZEPINE-11-YL)BENZOIC ACID DERIVATIVES INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2002-11-05 US disclosed
EP-0906907-B1 COMPOUNDS POTENTIATING RETINOID INST MED MOLECULAR DESIGN INC (JP) 2002-03-06 EP disclosed
US-20010039272-A1 Compounds activating pharmacological effect of retinoids KEMPHYS LTD. (JP) 2001-11-08 US disclosed
US-6121256-A 4-(2,3-(2,5-DIMETHYL-2,5-HEXANO)DIBENZO(B,F)(1,4)THIAZEPINE-11 -YL)BENZOIC ACID OR SALT INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2000-09-19 US disclosed
US-5929069-A CARBOXYPHENYL-SUBSTITUTED DIBENZO(B,F)(1,4)DIAZEPINE DERIVATIVES; TREATMENT OF VITAMIN A DEFICIENCY DISEASES, SKIN DISORDERS, LEUKEMIA INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 1999-07-27 US disclosed
EP-0906907-A1 COMPOUNDS POTENTIATING RETINOID Institute of Medicinal Molecular Design, Inc. (JP) 1999-04-07 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010039272-A1 Compounds activating pharmacological effect of retinoids RXRA, RXRG, RXRB RXRA 1/4885RXRB 3/4885RXRG 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.