SCHEMBL4815674

SCHEMBL4815674

Cc1cccc(Nc2ccc(N)cc2)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 3/20 0.54
RAB9A P51151 6/20 0.48
MAPT P10636 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
KDM4E B2RXH2 1/20 0.48
ALPG P10696 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
CYP1A2 P05177 3/20 0.45
HTT P42858 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2C19 P33261 2/20 0.45
NOS3 P29474 1/20 0.45
NOS2 P35228 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP2C9 P11712 1/20 0.45
ALOX12 P18054 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
GBA1 P04062 4/20 0.45
TP53 P04637 2/20 0.45

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
Hydrochloric Acid SCHEMBL4808551 0.98 ASIC3 (0.52) ASIC3RAB9AMAPTMEN1KMT2A
SCHEMBL18162478 0.85 MAPT (0.60) ASIC3RAB9AMAPTMEN1KMT2A
SCHEMBL229427 0.82 RAB9A (0.72) ASIC3RAB9AMAPTMEN1KMT2A
SCHEMBL4666258 0.81 MAPT (0.53) ASIC3RAB9AMAPTMEN1KMT2A
SCHEMBL4665629 0.81 SCN9A (0.61) RAB9AMAPTMEN1KMT2AKDM4E
SCHEMBL23609451 0.80 ALDH1A1 (0.50) ASIC3RAB9AMAPTMEN1KMT2A
SCHEMBL29973206 0.80 ALDH1A1 (0.50) ASIC3RAB9AMAPTMEN1KMT2A
SCHEMBL229747 0.80 RAB9A (0.59) ASIC3RAB9AMEN1KMT2AKDM4E
SCHEMBL27930256 0.77 NR4A1 (0.49) RAB9AMAPTMEN1KMT2AKDM4E
SCHEMBL14293042 0.77 TDP1 (0.50) ASIC3RAB9AMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7329288-B2 N-heteroaryl secondary para-phenylenediamine, a dye composition comprising such a para-phenylenediamine, a process for preparing this composition and use thereof L'OREAL S.A. (FR) 2008-02-12 US claimed
US-20060005323-A1 N-heteroaryl secondary para-phenylenediamine, a dye composition comprising such a para-phenylenediamine, a process for preparing this composition and use thereof L'OREAL S.A. (FR) 2006-01-12 US claimed
EP-1568694-A1 N-heteroaryl-para-phenylene diamines for colouring hair L'OREAL (FR) 2005-08-31 EP claimed
US-7329288-B2 N-heteroaryl secondary para-phenylenediamine, a dye composition comprising such a para-phenylenediamine, a process for preparing this composition and use thereof L'OREAL S.A. (FR) 2008-02-12 US disclosed
US-7329288-B2 N-heteroaryl secondary para-phenylenediamine, a dye composition comprising such a para-phenylenediamine, a process for preparing this composition and use thereof L'OREAL S.A. (FR) 2008-02-12 US disclosed
US-7329288-B2 N-heteroaryl secondary para-phenylenediamine, a dye composition comprising such a para-phenylenediamine, a process for preparing this composition and use thereof L'OREAL S.A. (FR) 2008-02-12 US disclosed
US-20060005323-A1 N-heteroaryl secondary para-phenylenediamine, a dye composition comprising such a para-phenylenediamine, a process for preparing this composition and use thereof L'OREAL S.A. (FR) 2006-01-12 US disclosed
EP-1568694-A1 N-heteroaryl-para-phenylene diamines for colouring hair L'OREAL (FR) 2005-08-31 EP disclosed