SCHEMBL9075867

SCHEMBL9075867

CCc1cccc(C2CCC(c3ccc(Oc4ccc(N)cc4C)c(C)c3)(c3ccc(Oc4ccc(N)cc4C)c(C)c3)CC2)c1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.33
SIGMAR1 Q99720 1/20 0.32
BACE1 P56817 1/20 0.31
DPP4 P27487 1/20 0.30

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
SCHEMBL9074695 0.92 SIGMAR1 (0.31) SIGMAR1
SCHEMBL9074613 0.92 DRD2 (0.38) PPARABACE1
SCHEMBL9075456 0.90 DRD2 (0.33) PPARA
SCHEMBL9075475 0.89 SPHK1 (0.33) PPARA
SCHEMBL9073206 0.88 SPHK1 (0.35)
SCHEMBL9074327 0.88 SPHK1 (0.35)
SCHEMBL9074805 0.88 SPHK1 (0.35)
SCHEMBL9075368 0.87 HTR2C (0.40) PPARABACE1DPP4
SCHEMBL9075958 0.86 PPARA (0.35) PPARA
SCHEMBL9075289 0.84 DRD2 (0.37) PPARABACE1

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-5545444-A Diamino compounds and liquid crystal aligning films CHISSO CORPORATION (JP) 1996-08-13 US disclosed
US-5430195-A Diamino compounds and liquid crystal aligning films CHISSO CORPORATION (JP) 1995-07-04 US disclosed
US-5414126-A Diamino compounds and liquid crystal aligning films CHISSO CORPORATION (JP) 1995-05-09 US disclosed