SCHEMBL6472676

SCHEMBL6472676

CC1(C)CC([SeH])C(C)(C)c2ccc(C#C[Si](C)(C)C)cc21

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RARB P10826 2/20 0.35
RARG P13631 2/20 0.35
CYP26A1 O43174 1/20 0.35
CYP3A4 P08684 1/20 0.35
RARA P10276 1/20 0.35
CRABP2 P29373 1/20 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
SCHEMBL6477078 0.80 CYP26A1 (0.33) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL3300659 0.77 RARB (0.55) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL9328615 0.71 RARA (0.35) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL4509176 0.70 GABRA5 (0.34) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL8866654 0.69 RARB (0.33) RARBRARG
SCHEMBL6664854 0.68 RARB (0.61) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL8631884 0.67 RARB (0.63) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL8629043 0.67 RARB (0.50) RARBRARGRARA
SCHEMBL9028813 0.66 RARB (0.38) RARBRARGCYP26A1CYP3A4RARA
SCHEMBL4849205 0.66 AKR1B1 (0.33) RARBRARGCYP26A1CYP3A4RARA

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-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 RARB 1728/4885RARG 1282/4885CYP26A1 78/4885

“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.