SCHEMBL4959128

SCHEMBL4959128

CCCCOc1cc2c(cc1C(=O)Oc1ccc(C(=O)O)cn1)C(C)(C)CCC2(C)C

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXRA P19793 19/20 0.67
PPARG P37231 1/20 0.55
NR1H3 Q13133 1/20 0.55
HNF4A P41235 5/20 0.55
RXRB P28702 2/20 0.51
RXRG P48443 2/20 0.51
RARA P10276 1/20 0.47
RARB P10826 1/20 0.47
RARG P13631 1/20 0.47

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
SCHEMBL6675620 0.98 RXRA (0.65) RXRAPPARGNR1H3HNF4ARXRB
SCHEMBL4959698 0.88 RXRA (0.55) RXRAPPARGNR1H3HNF4ARXRB
SCHEMBL6673775 0.88 RXRA (0.57) RXRAPPARGNR1H3HNF4ARXRB
SCHEMBL6676520 0.87 RXRA (0.56) RXRAPPARGNR1H3HNF4ARXRB
SCHEMBL6685049 0.86 RXRA (0.51) RXRAPPARGNR1H3HNF4ARXRB
SCHEMBL4960820 0.85 RXRA (0.52) RXRAPPARGNR1H3HNF4ARXRB
SCHEMBL4960828 0.85 RXRA (0.52) RXRAPPARGNR1H3HNF4ARXRB
SCHEMBL6915045 0.81 RXRA (0.81) RXRAHNF4ARXRBRXRGRARA
SCHEMBL9594812 0.81 RXRA (0.56) RXRAPPARGRXRBRXRGRARA
SCHEMBL4956986 0.80 RXRA (0.49) RXRAPPARGNR1H3HNF4ARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0862554-B1 AROMATIC CARBOXYLIC ACID ESTERS, THE PRODUCTION OF SAME AND USE OF SAME AS MEDICAMENTS HOFFMANN LA ROCHE (CH) 2004-10-20 EP claimed
JP-3061865-B2 2000-07-10 JP claimed
EP-0862554-A1 AROMATIC CARBOXYLIC ACID ESTERS, THE PRODUCTION OF SAME AND USE OF SAME AS MEDICAMENTS F. HOFFMANN-LA ROCHE AG (CH) 1998-09-09 EP claimed
US-5726191-A TREATEMENT OF LIGHT AND AGE DAMAGED SKIN HOFFMANN-LA ROCHE INC. (US) 1998-03-10 US claimed
WO-1997018192-A1 AROMATIC CARBOXYLIC ACID ESTERS, THE PRODUCTION OF SAME AND USE OF SAME AS MEDICAMENTS F. HOFFMANN-LA ROCHE AG (CH) 1997-05-22 WO claimed
EP-1930005-A1 Stabilized formulation of selective ligands of retinoic acid gamma-receptors Johnson and Johnson Consumer Companies, Inc. (US) 2008-06-11 EP disclosed
EP-1351685-B1 STABILIZED FORMULATION OF SELECTIVE LIGANDS OF RETINOIC ACID GAMMA-RECEPTORS JOHNSON & JOHNSON CONSUMER (US) 2008-02-27 EP disclosed
US-20050059707-A1 Stabilization of retinoid compounds RAO CHAKRADHARA S (US) 2005-03-17 US disclosed
US-6844364-B2 Stabilization of retinoid compounds JOHNSON & JOHNSON CONSUMER COMPANIES, INC. (US) 2005-01-18 US disclosed
EP-0862554-B1 AROMATIC CARBOXYLIC ACID ESTERS, THE PRODUCTION OF SAME AND USE OF SAME AS MEDICAMENTS HOFFMANN LA ROCHE (CH) 2004-10-20 EP disclosed
EP-1351685-A2 STABILIZED FORMULATION OF SELECTIVE LIGANDS OF RETINOIC ACID GAMMA-RECEPTORS JOHNSON & JOHNSON CONSUMER PRODUCTS, INC. (US) 2003-10-15 EP disclosed
US-20030032659-A1 Stabilization of retinoid compounds JOHNSON & JOHNSON CONSUMER COMPANIES, INC. 2003-02-13 US disclosed
WO-2002074310-A2 STABILIZED FORMULATION OF SELECTIVE LIGANDS OF RETINOIC ACID GAMMA-RECEPTORS JOHNSON & JOHNSON CONSUMER COMPANIES, INC. (US) 2002-09-26 WO disclosed
US-5958956-A SKIN DISORDERS; WOUND HEALING AGENTS HOFFMANN-LA ROCHE INC. (US) 1999-09-28 US disclosed
EP-0862554-A1 AROMATIC CARBOXYLIC ACID ESTERS, THE PRODUCTION OF SAME AND USE OF SAME AS MEDICAMENTS F. HOFFMANN-LA ROCHE AG (CH) 1998-09-09 EP disclosed
US-5726191-A TREATEMENT OF LIGHT AND AGE DAMAGED SKIN HOFFMANN-LA ROCHE INC. (US) 1998-03-10 US disclosed
WO-1997018192-A1 AROMATIC CARBOXYLIC ACID ESTERS, THE PRODUCTION OF SAME AND USE OF SAME AS MEDICAMENTS F. HOFFMANN-LA ROCHE AG (CH) 1997-05-22 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 (2 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-20050059707-A1 Stabilization of retinoid compounds STRA6, RXRA, RARA RXRA 2/4885PPARG 311/4885NR1H3 33/4885
US-20030032659-A1 Stabilization of retinoid compounds RXRA, RARA, RXRB RXRA 1/4885PPARG 146/4885NR1H3 14/4885

“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.