SCHEMBL6472409

SCHEMBL6472409

CCOC(=O)/C=C(\C)C#CS(=O)(=O)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP26B1 Q9NR63 5/20 0.41
CYP26A1 O43174 6/20 0.39
RXRA P19793 11/20 0.37
RXRG P48443 10/20 0.37
RARB P10826 3/20 0.37
RARG P13631 3/20 0.37
RARA P10276 2/20 0.37
RXRB P28702 9/20 0.36
CYP3A4 P08684 2/20 0.35

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
SCHEMBL6472410 1.00 CYP26B1 (0.41) CYP26B1CYP26A1RXRARXRGRARB
SCHEMBL7153988 0.90 RXRA (0.42) CYP26B1CYP26A1RXRARXRGRARB
SCHEMBL6479329 0.84 RXRA (0.46) CYP26B1CYP26A1RXRARXRGRARB
SCHEMBL6479333 0.84 RXRA (0.46) CYP26B1CYP26A1RXRARXRGRARB
SCHEMBL6476672 0.84 RXRA (0.41) CYP26B1CYP26A1RXRARXRGRARB
SCHEMBL6476670 0.84 RXRA (0.41) CYP26B1CYP26A1RXRARXRGRARB
SCHEMBL7559490 0.77 CYP26A1 (0.41) CYP26B1CYP26A1RXRARXRGRARB
SCHEMBL7558455 0.77 RARB (0.38) CYP26B1CYP26A1RXRARXRGRARB
SCHEMBL7559493 0.77 CYP26A1 (0.41) CYP26B1CYP26A1RXRARXRGRARB
SCHEMBL6472723 0.77 RARB (0.38) CYP26B1CYP26A1RXRARXRGRARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030012803-A1 Novel heteroethynylenic compounds and pharmaceutical and cosmetic compositions containing them GALDERMA RESEARCH & DEVELOPMENT (FR) 2003-01-16 US claimed
US-6444709-B1 SKIN DISORDERS; ANTIINFLAMMATORY AGENTS; ANTIARTHRITIC AGENTS; CARDIOVASCULAR DISORDERS GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2002-09-03 US claimed
US-6921777-B2 Heteroethynylenic compounds and pharmaceutical and cosmetic compositions containing them GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-07-26 US disclosed
US-20030012803-A1 Novel heteroethynylenic compounds and pharmaceutical and cosmetic compositions containing them GALDERMA RESEARCH & DEVELOPMENT (FR) 2003-01-16 US disclosed
US-6444709-B1 SKIN DISORDERS; ANTIINFLAMMATORY AGENTS; ANTIARTHRITIC AGENTS; CARDIOVASCULAR DISORDERS GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2002-09-03 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-20030012803-A1 Novel heteroethynylenic compounds and pharmaceutical and cosmetic compositions containing them TYR, CYP1B1, MITF CYP26B1 111/4885CYP26A1 78/4885RXRA 935/4885

“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.