SCHEMBL5133404

SCHEMBL5133404

Nc1ccc(N)c(-c2ccccc2N)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.65
L3MBTL1 Q9Y468 2/20 0.65
CYP3A4 P08684 5/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
NPC1 O15118 4/20 0.52
RAB9A P51151 3/20 0.52
TDP1 Q9NUW8 2/20 0.52
TP53 P04637 1/20 0.52
TSHR P16473 1/20 0.52
MAPK1 P28482 1/20 0.52
PTPRC P08575 2/20 0.50
LMNA P02545 2/20 0.50
HPGD P15428 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
MEN1 O00255 1/20 0.50
APAF1 O14727 1/20 0.50
TDP2 O95551 1/20 0.50
NSD2 O96028 1/20 0.50
PLA2G1B P04054 1/20 0.50
POLB P06746 1/20 0.50

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
SCHEMBL3338155 0.87 CASP1 (0.46) ALDH1A1L3MBTL1CYP3A4SMN1; SMN2NPC1
SCHEMBL6011318 0.85 ALDH1A1 (0.65) ALDH1A1L3MBTL1CYP3A4SMN1; SMN2NPC1
SCHEMBL1578426 0.82 SMN1; SMN2 (0.46) ALDH1A1L3MBTL1CYP3A4SMN1; SMN2NPC1
SCHEMBL6573277 0.82 SMN1; SMN2 (0.45) ALDH1A1L3MBTL1CYP3A4SMN1; SMN2NPC1
SCHEMBL173368 0.82 PLA2G7 (0.56) ALDH1A1L3MBTL1CYP3A4SMN1; SMN2NPC1
SCHEMBL6570945 0.82 ALDH1A1 (0.45) ALDH1A1L3MBTL1CYP3A4SMN1; SMN2NPC1
SCHEMBL452550 0.82 PLA2G7 (0.67) ALDH1A1L3MBTL1CYP3A4SMN1; SMN2NPC1
SCHEMBL3786791 0.82 ALDH1A1 (0.54) ALDH1A1L3MBTL1CYP3A4SMN1; SMN2NPC1
SCHEMBL3780745 0.82 PLA2G7 (0.67) ALDH1A1L3MBTL1CYP3A4SMN1; SMN2NPC1
SCHEMBL3784463 0.82 ALDH1A1 (0.54) ALDH1A1L3MBTL1CYP3A4SMN1; SMN2NPC1

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 364 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117666224-A Method for preparing energy-storage electrochromic film of imine covalent organic framework on flexible film by electrodeposition 江西理工大学 2024-03-08 CN claimed
CN-105916482-A Gradual hair color compositions and methods of use thereof 酷姆国际公司 2016-08-31 CN claimed
CN-101444460-B Oxidation dye composition, oxidation dyeing process and use OU LAIYA 2013-08-14 CN claimed
CN-101229106-B Dye composition of acidic ph comprising 2,3-diamino-6,7-dihydro-1h,5h-pyrazolo[1,2-a]pyrazol-1-one, a para- phenylenediamine, a meta-aminophenol and an oxidizing agent OREAL 2013-04-10 CN claimed
CN-100528126-C Composition comprising at least one coupler chosen from 2-chloro-6-methyl-3-aminophenol and addition salts thereof, at least one oxidation base, and at least one associative polymer comprising at leas OREAL (FR) 2009-08-19 CN claimed
CN-1882307-A Method for dyeing fibres containing keratine HENKEL KGAA (DE) 2006-12-20 CN claimed
CN-1203836-C Keratinous fibre oxidation dyeing composition contg laccase and dyeing method using same OREAL (FR) 2005-06-01 CN claimed
CN-1201717-C Composite for oxidation-dyeing keratin fibre and its dyeing method OREAL (FR) 2005-05-18 CN claimed
CN-1198570-C Oxidation dyeing composition for keratin fibres and dyeing method using said composition OREAL (FR) 2005-04-27 CN claimed
CN-1602836-A Dye composition comprising at least one oxidation base, 2-chloro-6-methyl-3-aminophenol and 3-methyl-1-phenyl-5-pyrazolone OREAL (FR) 2005-04-06 CN claimed
CN-1254553-A Ceratin-fibre composition for oxidation dying and method for dying with said composition OREAL (FR) 2000-05-31 CN claimed
CN-1242699-A Oxidation dyeing composition for keratin fibres and dyeing method using said composition OREAL (FR) 2000-01-26 CN claimed
CN-1242697-A Composition for the oxidation dyeing of keratin fibres and dyeing process using this composition OREAL (FR) 2000-01-26 CN claimed
CN-1242700-A Oxidation dyeing composition for keratin, and dyeing method using same OREAL (FR) 2000-01-26 CN claimed
CN-1241135-A Oxidation dyeing composition for keratin fibres OREAL (FR) 2000-01-12 CN claimed
CN-1241137-A Composition for the oxidation dyeing of keratin fibres and dyeing process using this composition OREAL (FR) 2000-01-12 CN claimed
CN-1241138-A Oxidation dyeing composition for keratin fibres and dyeing method using said composition OREAL (FR) 2000-01-12 CN claimed
CN-1241136-A Oxidation dye composition for keratin fibres OREAL (FR) 2000-01-12 CN claimed
CN-1239422-A Oxidation dyeing compsn. for keratin fibres and dyeing method of using same OREAL (FR) 1999-12-22 CN claimed
CN-1236609-A Oxidation dyeing composition of keration fibre and dyeing method using same OREAL (FR) 1999-12-01 CN claimed