SCHEMBL6473205

SCHEMBL6473205

COCOc1c(B(O)O)ccc2c1C(C)(C)CCC2(C)C

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.42
CYP1A2 P05177 1/20 0.42
PTPN1 P18031 1/20 0.34
RARG P13631 2/20 0.32
CYP3A4 P08684 4/20 0.32
CYP26A1 O43174 3/20 0.31
CYP26B1 Q9NR63 1/20 0.31
PPARG P37231 1/20 0.30
RARA P10276 1/20 0.30
RARB P10826 1/20 0.30

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
SCHEMBL6874295 0.79 TP53 (0.41) TP53CYP1A2PTPN1RARGCYP3A4
SCHEMBL5846349 0.77 RARG (0.44) RARGRARARARB
SCHEMBL7583672 0.75 EGFR (0.37) TP53CYP1A2PTPN1RARGRARA
SCHEMBL8443725 0.73 TP53 (0.34) TP53CYP1A2
SCHEMBL5846427 0.72 RXRA (0.37) RARGCYP3A4CYP26A1CYP26B1RARA
SCHEMBL6473259 0.71 TP53 (0.40) TP53CYP1A2PTPN1RARGCYP3A4
SCHEMBL5846235 0.70 RARG (0.50) RARGRARARARB
SCHEMBL2279409 0.68 PTPN1 (0.55) CYP1A2PTPN1CYP3A4
SCHEMBL30683252 0.68 TP53 (0.46) TP53CYP1A2RARGRARARARB
SCHEMBL26923019 0.68 TP53 (0.46) TP53CYP1A2RARGRARARARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6924388-B2 Bicyclic aromatic compounds and pharmaceutical/cosmetic compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-08-02 US disclosed
US-20040092594-A1 Bicyclic aromatic compounds and pharmaceutical/cosmetic compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-05-13 US disclosed
US-6632963-B1 Are useful for the treatment of a wide variety of disease states, whether human or veterinary, for example dermatological, rheumatic, respiratory, cardiovascular and ophthalmological disorders, as well as for the treatment of GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2003-10-14 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 (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-20040092594-A1 Bicyclic aromatic compounds and pharmaceutical/cosmetic compositions comprised thereof AHR, TYR, MC1R TP53 1418/4885CYP1A2 44/4885PTPN1 2595/4885

“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.