SCHEMBL4810326

SCHEMBL4810326

Nc1ccc(Nc2ncccc2O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.56
▸ NPC1 O15118 5/20 0.56
▸ L3MBTL1 Q9Y468 3/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ USP2 O75604 1/20 0.56
▸ CA12 O43570 1/20 0.51
▸ CA1 P00915 1/20 0.51
▸ CA2 P00918 1/20 0.51
▸ CA9 Q16790 1/20 0.51
▸ RAD52 P43351 1/20 0.47
▸ SMN1; SMN2 Q16637 5/20 0.46
▸ MAPT P10636 5/20 0.46
▸ AHR P35869 1/20 0.46
▸ ALDH1A1 P00352 4/20 0.45
▸ HTT P42858 2/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ ALOX12 P18054 1/20 0.45
▸ CYP2C19 P33261 1/20 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 SCHEMBL4813485 0.98 RAB9A (0.55) RAB9ANPC1L3MBTL1KDM4EUSP2
SCHEMBL11971210 0.85 DHODH (0.61) RAB9ANPC1L3MBTL1KDM4ESMN1; SMN2
SCHEMBL11643488 0.84 RAB9A (0.60) RAB9ANPC1L3MBTL1KDM4ECA12
SCHEMBL15062783 0.83 CYP2C9 (0.46) RAB9ANPC1L3MBTL1KDM4EUSP2
SCHEMBL7695744 0.81 CA12 (0.68) RAB9ANPC1L3MBTL1KDM4EUSP2
SCHEMBL14293821 0.80 ALDH1A1 (0.49) RAB9ANPC1L3MBTL1KDM4EUSP2
SCHEMBL21497150 0.80 EPHX2 (0.56) RAB9AALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL4811572 0.78 RAB9A (0.50) RAB9ANPC1L3MBTL1KDM4EUSP2
SCHEMBL4810235 0.77 MAPT (0.53) RAB9ANPC1L3MBTL1KDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL4813275 0.76 RAB9A (0.49) RAB9ANPC1L3MBTL1KDM4EUSP2

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
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