SCHEMBL5888064

SCHEMBL5888064

CC1(C)CCC(C)(C)c2cc(C(N)c3ccc(C(=O)O)cc3)ccc21

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 12/20 0.72
RXRB P28702 10/20 0.72
RARB P10826 10/20 0.62
RARG P13631 10/20 0.62
RXRG P48443 6/20 0.62
RARA P10276 8/20 0.62
CYP26A1 O43174 2/20 0.62
CYP3A4 P08684 2/20 0.62
CYP26B1 Q9NR63 1/20 0.62
CRABP2 P29373 1/20 0.58

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
SCHEMBL5712092 0.89 RARB (0.79) RXRARXRBRARBRARGRXRG
SCHEMBL8458824 0.84 RXRA (1.00) RXRARXRBRARBRARGRXRG
SCHEMBL7422602 0.84 RXRA (1.00) RXRARXRBRARBRARGRXRG
SCHEMBL8839089 0.83 RXRA (0.69) RXRARXRBRARBRARGRXRG
SCHEMBL8557387 0.83 RXRA (0.49) RXRARXRBRARBRARGRXRG
SCHEMBL8681591 0.82 RXRA (0.71) RXRARXRBRARBRARGRXRG
SCHEMBL9519749 0.82 RXRA (0.71) RXRARXRBRARBRARGRXRG
SCHEMBL21794444 0.81 RXRA (0.70) RXRARXRBRARBRARGRXRG
SCHEMBL8093046 0.81 RARB (0.64) RXRARXRBRARBRARGRXRG
SCHEMBL8100810 0.81 RXRA (0.69) RXRARXRBRARBRARGRXRG

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-6992095-B2 Stilbene compounds comprising an adamantyl group, compositions and methods thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2006-01-31 US disclosed
US-20040067971-A1 Stilbene compounds comprising an adamantyl group, compositions and methods thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-04-08 US disclosed
US-20020010337-A1 Stilbene compounds comprising an adamantyl group, compositions and methods thereof BERNARDON JEAN-MICHEL (FR) 2002-01-24 US disclosed
US-6214878-B1 SKIN DISORDERS; RHEUMATIC DISEASES; RESPIRATORY SYSTEM DISORDERS; CARDIOVASCULAR DISORDERS; VISION DEFECTS GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2001-04-10 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-20040067971-A1 Stilbene compounds comprising an adamantyl group, compositions and methods thereof SQLE, FDFT1, PIGS RXRA 1230/4885RXRB 414/4885RARB 406/4885
US-20020010337-A1 Stilbene compounds comprising an adamantyl group, compositions and methods thereof SQLE, FDFT1, PIGS RXRA 1230/4885RXRB 414/4885RARB 406/4885

“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.