SCHEMBL5845951

SCHEMBL5845951

CCOC(=O)c1ccc(-c2ccc(-c3ccc(O)cc3)c(-c3ccc4c(c3)C(C)(C)CCC4(C)C)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RARG P13631 15/20 0.56
RARB P10826 14/20 0.56
RARA P10276 12/20 0.56
RXRA P19793 3/20 0.55
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
ESR1 P03372 1/20 0.49
CA7 P43166 1/20 0.49
CA9 Q16790 1/20 0.49
ESR2 Q92731 1/20 0.49
CA14 Q9ULX7 1/20 0.49
PDK2 Q15119 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
SCHEMBL6730351 0.91 RARB (0.53) RARGRARBRARARXRAPDK2
SCHEMBL5846311 0.91 RARG (0.56) RARGRARBRARARXRAPDK2
SCHEMBL5846075 0.89 RARB (0.60) RARGRARBRARARXRAPDK2
SCHEMBL344714 0.88 RARB (0.71) RARGRARBRARARXRACA12
SCHEMBL5846244 0.87 RARG (0.54) RARGRARBRARARXRA
SCHEMBL5846741 0.87 RARB (0.65) RARGRARBRARARXRACA12
SCHEMBL5845556 0.87 RARG (0.57) RARGRARBRARARXRAPDK2
SCHEMBL5699634 0.86 RARG (0.52) RARGRARBRARARXRACA12
SCHEMBL5846807 0.85 RARG (0.53) RARGRARBRARARXRAPDK2
SCHEMBL2917374 0.84 RARB (0.76) RARGRARBRARARXRA

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-7148245-B2 Biphenyl derivatives substituted with an aromatic or heteroaromatic radical, and pharmaceutical and cosmetic compositions containing them GALDERMA RESEARCH & DEVELOPMENT (FR) 2006-12-12 US disclosed
US-20040030141-A1 Biphenyl derivatives substituted with an aromatic or heteroaromatic radical, and pharmaceutical and cosmetic compositions containing them GALDERMA RESEARCH & DEVELOPMENT 2004-02-12 US disclosed
US-6316009-B1 FOR THERAPY OF DERMATOLOGICAL COMPLAINTS ASSOCIATED WITH A KERATINIZATION DISORDER, AND FOR COMBATING AGEING OF THE SKIN GALDERMA RESEARCH & DEVELOPMENT (FR) 2001-11-13 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-20040030141-A1 Biphenyl derivatives substituted with an aromatic or heteroaromatic radical, and pharmaceutical and cosmetic compositions containing them AHR, TYR, CYP1A1 RARG 39/4885RARB 26/4885RARA 24/4885

“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.