SCHEMBL7422927

SCHEMBL7422927

COC(=O)c1ccc(C(=O)c2ccc3c(c2)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 10/20 0.70
RARB P10826 9/20 0.70
RARG P13631 8/20 0.70
RXRB P28702 8/20 0.70
RXRG P48443 6/20 0.70
CYP3A4 P08684 6/20 0.67
CYP26A1 O43174 7/20 0.62
RARA P10276 7/20 0.61
CYP26B1 Q9NR63 2/20 0.61
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
TSHR P16473 1/20 0.51
MAPK1 P28482 1/20 0.51
CYP2C19 P33261 1/20 0.51
PGR P06401 1/20 0.48
ADORA3 P0DMS8 1/20 0.48
TBXA2R P21731 1/20 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
SCHEMBL2788640 0.91 CYP3A4 (0.70) RXRARARBRARGRXRBRXRG
SCHEMBL8026112 0.90 RARB (0.58) RXRARARBRARGRXRBRXRG
SCHEMBL7899482 0.90 RXRA (0.61) RXRARARBRARGRXRBRXRG
SCHEMBL9319204 0.88 CYP3A4 (0.67) RXRARARBRARGRXRBRXRG
SCHEMBL8733241 0.87 RARB (0.83) RXRARARBRARGRXRBRXRG
SCHEMBL7421190 0.85 RXRA (0.72) RXRARARBRARGRXRBRXRG
SCHEMBL7421758 0.85 RXRA (0.72) RXRARARBRARGRXRBRXRG
SCHEMBL9187540 0.85 CYP3A4 (0.76) RXRARARBRARGRXRBRXRG
SCHEMBL9187032 0.84 CYP3A4 (0.74) RXRARARBRARGRXRBRXRG
SCHEMBL20398871 0.84 RARB (0.57) RXRARARBRARGRXRBRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0260162-B1 BICYCLIC AROMATIC DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINES CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA Groupement d'Intérêt Economique dit: (FR) 1990-11-14 EP claimed
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
US-5837725-A Bridged bicyclic aromatic compounds and their use in modulating gene expression of retinoid receptors SRI INTERNATIONAL (US) 1998-11-17 US disclosed
US-5824484-A GENTIC ENGINEERING AND SCREENING A SUBSTANCE FOR RETINOID X RECEPTORS LA JOLLA CANCER RESEARCH FOUNDATION (US) 1998-10-20 US disclosed
US-5552271-A SCREENING FOR SUBSTANCES WHICH INDUCE FORMATION OF RETINOID XRECEPTOR HOMODIMERS LA JOLLA CANCER RESEARCH FOUNDATION (US) 1996-09-03 US disclosed
US-5466861-A Bridged bicyclic aromatic compounds and their use in modulating gene expression of retinoid receptors SRI INTERNATIONAL (US) 1995-11-14 US disclosed
EP-0671005-A1 RXR HOMODIMER FORMATION AND BRIDGED BICYCLIC AROMATIC COMPOUNDS AND THEIR USE IN MODULATING GENE EXPRESSION LA JOLLA CANCER RESEARCH FOUNDATION (US) 1995-09-13 EP disclosed
WO-1994012880-A2 RXR HOMODIMER FORMATION AND BRIDGED BICYCLIC AROMATIC COMPOUNDS AND THEIR USE IN MODULATING GENE EXPRESSION LA JOLLA CANCER RESEARCH FOUNDATION (US) 1994-06-09 WO 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 1/4885RARB 5/4885RARG 4/4885

“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.