SCHEMBL6656635

SCHEMBL6656635

[CH2]CCOCCCCCCOC

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.34
THRB P10828 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 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
SCHEMBL9691389 1.00 ALDH1A1 (0.39) ALDH1A1MEN1THRBHTTKMT2A
SCHEMBL29220967 1.00 ALDH1A1 (0.39) ALDH1A1MEN1THRBHTTKMT2A
SCHEMBL2596247 0.97 ALDH1A1 (0.36) ALDH1A1MEN1THRBHTTKMT2A
SCHEMBL329136 0.92 ALDH1A1 (0.31) ALDH1A1
SCHEMBL147280 0.92
SCHEMBL19690828 0.92 ALDH1A1 (0.31) ALDH1A1
SCHEMBL329310 0.92 ALDH1A1 (0.31) ALDH1A1
SCHEMBL95923 0.90 ALDH1A1 (0.39) ALDH1A1MEN1THRBHTTKMT2A
SCHEMBL2146763 0.90 ALDH1A1 (0.39) ALDH1A1MEN1THRBHTTKMT2A
SCHEMBL199247 0.86 ALDH1A1 (0.36) ALDH1A1MEN1THRBHTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1033391-B1 Fluorescent tracer dyes ROHM & HAAS (US) 2004-07-21 EP disclosed
EP-0984942-B1 LIQUID BENZ-ISO-QUINOLINE DERIVATIVES UNITED COLOR MFG INC (US) 2003-09-10 EP disclosed
US-6150306-A Fluorescent tracer dyes MORTON INTERNATIOANL INC. (US) 2000-11-21 US disclosed
EP-1033391-A2 Fluorescent tracer dyes ROHM AND HAAS COMPANY (US) 2000-09-06 EP disclosed
EP-0984942-A1 LIQUID BENZ-ISO-QUINOLINE DERIVATIVES United Color Manufacturing Inc. (US) 2000-03-15 EP disclosed
US-5858930-A Liquid Benz-iso-Quinoline derivatives UNITED COLOR MANUFACTURING, INC. (US) 1999-01-12 US disclosed
WO-1998054150-A1 LIQUID BENZ-ISO-QUINOLINE DERIVATIVES UNITED COLOR MANUFACTURING, INC. (US) 1998-12-03 WO disclosed