SCHEMBL6875748

SCHEMBL6875748

C=C(C(=O)OC)c1cc(-c2cc3c(cc2C)C(C)(C)CCC3(C)C)ccc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 15/20 0.48
RXRG P48443 8/20 0.48
RXRB P28702 7/20 0.48
RARG P13631 7/20 0.45
RARB P10826 7/20 0.45
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42
RARA P10276 6/20 0.42
MEN1 O00255 1/20 0.42
CYP26A1 O43174 1/20 0.42
ABCB11 O95342 1/20 0.42

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
SCHEMBL6876418 0.87 RXRA (0.54) RXRARXRGRXRBRARGRARB
SCHEMBL6874227 0.78 RXRA (0.47) RXRARXRGRXRBRARGRARB
SCHEMBL6870964 0.77 RXRA (0.51) RXRARXRGRXRBRARGRARB
SCHEMBL6878334 0.75 RARG (0.45) RXRARXRGRXRBRARGRARB
SCHEMBL6875697 0.74 RARB (0.43) RXRARXRGRXRBRARGRARB
SCHEMBL6875751 0.74 ALDH1A1 (0.51) RXRARXRGRXRBRARGRARB
SCHEMBL6876040 0.74 RXRA (0.45) RXRARXRGRXRBRARGRARB
SCHEMBL6876532 0.73 RARG (0.49) RXRARXRGRXRBRARGRARB
SCHEMBL6869955 0.72 RXRA (0.52) RXRARXRGRXRBRARGRARB
SCHEMBL6877472 0.72 PTPN11 (0.48) RXRARXRGRXRBRARGRARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 196/4885RXRG 211/4885RXRB 238/4885
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 55/4885RXRG 87/4885RXRB 91/4885

“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.