SCHEMBL6259604

SCHEMBL6259604

Cc1c(N)cc(CCCO)cc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TNKS2 Q9H2K2 1/20 0.42
KDM4E B2RXH2 2/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
IGF1R P08069 2/20 0.37
ALOX15 P16050 2/20 0.37
CA2 P00918 1/20 0.37
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
BCHE P06276 1/20 0.36
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL29670157 0.89 MAPT (0.45) RAB9ANPC1HPGDMAPK1HTT
SCHEMBL109101 0.89 MAPT (0.45) RAB9ANPC1HPGDMAPK1HTT
SCHEMBL3226328 0.81 HTT (0.47) RAB9ANPC1HPGDMAPK1HTT
SCHEMBL5849966 0.76 TRPA1 (0.45) RAB9ANPC1HPGDMAPK1HTT
SCHEMBL2986688 0.73 TNKS2 (0.52) RAB9ANPC1HPGDMAPK1HTT
SCHEMBL8403313 0.73 NPC1 (0.56) RAB9ANPC1HPGDMAPK1HTT
SCHEMBL8398361 0.73 NPC1 (0.56) RAB9ANPC1HPGDMAPK1HTT
SCHEMBL8400534 0.73 NPC1 (0.56) RAB9ANPC1HPGDMAPK1HTT
SCHEMBL8398403 0.73 NPC1 (0.56) RAB9ANPC1HPGDMAPK1HTT
SCHEMBL5150574 0.72 TNKS2 (0.43) RAB9ANPC1HPGDMAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1378229-B1 Composition for the dyeing of human hair KPSS KAO GMBH (DE) 2005-10-12 EP claimed
US-6852133-B2 Composition for the dyeing of human hair KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2005-02-08 US claimed
CN-111989082-B Catalytic dye system ELC 管理有限责任公司 2023-10-31 CN disclosed
CN-111971017-B Method for forming catalytic dye system ELC 管理有限责任公司 2023-07-28 CN disclosed
CN-111989082-A Catalytic dye system ELC 管理有限责任公司 2020-11-24 CN disclosed
CN-111971017-A Method for forming catalytic dye systems ELC 管理有限责任公司 2020-11-20 CN disclosed
CN-111918633-A Thickened catalytic dye systems ELC 管理有限责任公司 2020-11-10 CN disclosed
EP-1438948-B1 Composition for the dyeing of human hair KPSS KAO GMBH (DE) 2005-10-19 EP disclosed
US-6852133-B2 Composition for the dyeing of human hair KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2005-02-08 US disclosed
US-20040139564-A1 Composition for the dyeing of human hair KPSS - KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2004-07-22 US disclosed
EP-1438948-A2 Composition for the dyeing of human hair KPSS-Kao Professional Salon Services GmbH (DE) 2004-07-21 EP disclosed