SCHEMBL6879445

SCHEMBL6879445

COc1c(C=CC(=O)O)cccc1-c1cc2c(cc1C)C(C)(C)CCC2(C)C

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXRA P19793 8/20 0.56
RARG P13631 4/20 0.44
RARB P10826 2/20 0.44
RXRG P48443 3/20 0.42
RXRB P28702 2/20 0.42
RARA P10276 3/20 0.41
CYP26A1 O43174 2/20 0.41
CYP26B1 Q9NR63 1/20 0.41
NFE2L2 Q16236 2/20 0.41
CYP3A4 P08684 1/20 0.40
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
PTGER4 P35408 2/20 0.39
PTGER3 P43115 2/20 0.39
PTGER2 P43116 2/20 0.39
PTGER1 P34995 1/20 0.39

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
SCHEMBL6880805 0.89 RXRA (0.52) RXRARARGRARBRXRGRXRB
SCHEMBL6880784 0.86 RXRA (0.52) RXRARARGRARBRXRGRXRB
SCHEMBL6878591 0.85 RXRA (0.63) RXRARARGRARBRXRGRXRB
SCHEMBL6879963 0.84 RXRA (0.49) RXRARARGRARBRXRGRXRB
SCHEMBL6870966 0.78 RXRA (0.54) RXRARARGRARBRXRGRXRB
SCHEMBL6879439 0.76 RXRA (0.45) RXRARARGRARBRXRGRXRB
SCHEMBL6879427 0.76 RXRA (0.73) RXRARARGRARBRARACYP26A1
SCHEMBL8189844 0.76 RXRA (0.62) RXRARARGRARBRXRGRXRB
SCHEMBL8189841 0.76 RXRA (0.62) RXRARARGRARBRXRGRXRB
SCHEMBL7761572 0.76 RXRA (0.46) RXRARARGRARBRXRGRXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030135053-A1 For use in human or veterinary conditions, that may be dermatological, rheumatic, respiratory, or cardiovascular and may be used in cosmetics BERNARDON JEAN-MICHEL 2003-07-17 US claimed
US-20030060491-A1 Bicyclic aromatic compounds BERNARDON JEAN-MICHEL (FR) 2003-03-27 US claimed
EP-0832081-B1 BICYCLIC-AROMATIC COMPOUNDS GALDERMA RECH DERMATOLOGIQUE (FR) 2003-01-29 EP claimed
US-6825360-B1 Bicyclic aromatic compounds GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2004-11-30 US disclosed
US-20030135053-A1 For use in human or veterinary conditions, that may be dermatological, rheumatic, respiratory, or cardiovascular and may be used in cosmetics BERNARDON JEAN-MICHEL 2003-07-17 US disclosed
US-20030060491-A1 Bicyclic aromatic compounds BERNARDON JEAN-MICHEL (FR) 2003-03-27 US disclosed
US-6515021-B1 Bicyclic aromatic compounds CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2003-02-04 US disclosed
US-6147255-A TOPICAL AND SYSTEMIC TREATMENT OF DERMATOLOGICAL COMPLAINTS ASSOCIATED WITH KERATINIZATION DISORDER WHICH HAS EFFECT ON DIFFERENTIATION AND ON PROLIFERATION CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2000-11-14 US 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-20030060491-A1 Bicyclic aromatic compounds MITF, TYR, PAH RXRA 196/4885RARG 474/4885RARB 529/4885
US-20030135053-A1 For use in human or veterinary conditions, that may be dermatological, rheumatic, respiratory, or cardiovascular and may be used in cosmetics MITF, TYR, PAH RXRA 55/4885RARG 69/4885RARB 93/4885

“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.