SCHEMBL9051247

SCHEMBL9051247

CCOC(=O)c1ccc(-c2cc(CBr)c3cc4c(cc3c2)C(C)(C)CCC4(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RARA P10276 11/20 0.53
RARB P10826 11/20 0.53
RARG P13631 7/20 0.53
PDK2 Q15119 2/20 0.41
PDGFRB P09619 1/20 0.40
PDGFRA P16234 1/20 0.40
RXRA P19793 4/20 0.39
HNF4A P41235 2/20 0.39
CYP3A4 P08684 1/20 0.39
FDFT1 P37268 1/20 0.38

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
SCHEMBL9049309 0.90 RARB (0.52) RARARARBRARGPDK2PDGFRB
SCHEMBL9050339 0.88 RARB (0.49) RARARARBRARGPDK2PDGFRB
SCHEMBL9117300 0.87 RARB (0.54) RARARARBRARGPDK2PDGFRB
SCHEMBL9051118 0.87 RARA (0.51) RARARARBRARGPDK2RXRA
SCHEMBL9119758 0.86 RARB (0.53) RARARARBRARGPDK2PDGFRB
SCHEMBL9051778 0.86 RARB (0.53) RARARARBRARGPDK2PDGFRB
SCHEMBL9050464 0.85 KCNH2 (0.48) RARARARBRARGPDK2
SCHEMBL9051144 0.85 RARB (0.53) RARARARBRARGPDK2PDGFRB
SCHEMBL9062592 0.84 RARB (0.50) RARARARBRARGPDK2PDGFRB
SCHEMBL9050623 0.84 RARB (0.52) RARARARBRARGRXRAHNF4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1995033745-A9 NOVEL COMPOUNDS USEFUL IN MODULATING GENE EXPRESSION OF RETINOID RESPONSIVE GENES AND/OR HAVING ANTI-AP-1 ACTIVITY 1996-01-18 WO disclosed
WO-1995033745-A2 NOVEL COMPOUNDS USEFUL IN MODULATING GENE EXPRESSION OF RETINOID RESPONSIVE GENES AND/OR HAVING ANTI-AP-1 ACTIVITY SRI INTERNATIONAL (US) 1995-12-14 WO disclosed