SCHEMBL18104292

SCHEMBL18104292

Cc1ccc(N(c2ccc([Si](c3ccc(Br)cc3)(c3ccc(Br)cc3)c3ccc(N(c4ccc(C)cc4C)c4ccc(C)cc4C)cc3)cc2)c2ccc(C)cc2C)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
RAPGEF4 Q8WZA2 1/20 0.33
IGF1R P08069 1/20 0.31
CRHR1 P34998 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
SCHEMBL18104291 0.90 ALDH1A1 (0.34) ALDH1A1CRHR1
SCHEMBL15768667 0.90 ALDH1A1 (0.44) ALDH1A1RAPGEF4IGF1RCRHR1
SCHEMBL5422052 0.87 ALDH1A1 (0.44) ALDH1A1RAPGEF4IGF1RCRHR1
SCHEMBL18104319 0.86 ALDH1A1 (0.31) ALDH1A1CRHR1
SCHEMBL5668633 0.85 ALDH1A1 (0.40) ALDH1A1RAPGEF4IGF1R
SCHEMBL2542866 0.85 ALDH1A1 (0.38) ALDH1A1RAPGEF4CRHR1
SCHEMBL2312975 0.85 ALDH1A1 (0.48) ALDH1A1RAPGEF4IGF1RCRHR1
SCHEMBL18104299 0.84 UTS2R (0.34) CRHR1
SCHEMBL18104281 0.84 CYP2C19 (0.34) ALDH1A1CRHR1
SCHEMBL5666163 0.84 ALDH1A1 (0.39) ALDH1A1RAPGEF4

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-9972783-B2 High energy triarylamine compounds for hole transport materials E I DU PONT DE NEMOURS AND COMPANY (US) 2018-05-15 US disclosed
US-20160285000-A1 HIGH ENERGY TRIARYLAMINE COMPOUNDS FOR HOLE TRANSPORT MATERIALS LG CHEM, LTD. (KR) 2016-09-29 US disclosed
US-20160285000-A1 HIGH ENERGY TRIARYLAMINE COMPOUNDS FOR HOLE TRANSPORT MATERIALS LG CHEM, LTD. (KR) 2016-09-29 US disclosed