SCHEMBL28049339

SCHEMBL28049339

NNP(=O)(O)Oc1cccc(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
OGG1 O15527 1/20 0.48
HTT P42858 1/20 0.45
WDR5 P61964 1/20 0.41
ALDH1A1 P00352 2/20 0.39
MAPT P10636 1/20 0.39
SRC P12931 1/20 0.39
LMNA P02545 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ACP3 P15309 1/20 0.38
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.37
ALOX12 P18054 1/20 0.37
NOTUM Q6P988 1/20 0.37
MAOB P27338 1/20 0.37
AOC3 Q16853 1/20 0.37

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
SCHEMBL29093880 0.80 CYP1A2 (0.56) CYP1A2CYP2D6CYP2C9CYP2C19OGG1
SCHEMBL7602618 0.80 SRC (0.58) CYP1A2CYP2D6CYP2C9CYP2C19OGG1
SCHEMBL28200098 0.80 NPC1 (0.44) ALDH1A1SRCLMNANPC1RAB9A
SCHEMBL28045406 0.79 MEN1 (0.57) CYP1A2CYP2C9CYP2C19HTTALDH1A1
SCHEMBL9259535 0.76 CYP1A2 (0.59) CYP1A2CYP2D6CYP2C9CYP2C19OGG1
SCHEMBL8849562 0.75 CYP1A2 (0.54) CYP1A2CYP2D6CYP2C9CYP2C19OGG1
SCHEMBL28200751 0.75 MEN1 (0.50) ALDH1A1MAPTLMNAACP3GAA
SCHEMBL11099147 0.74 CYP1A2 (0.57) CYP1A2CYP2D6CYP2C9CYP2C19OGG1
SCHEMBL8849551 0.74 CYP1A2 (0.57) CYP1A2CYP2D6CYP2C9CYP2C19OGG1
SCHEMBL31561763 0.74 CYP1A2 (0.57) CYP1A2CYP2D6CYP2C9CYP2C19OGG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105272877-A Preparation method of 3-chlorophenylhydrazine phosphate TIANJIN CHEM REAGENT RES INST 2016-01-27 CN claimed
CN-107663161-A A kind of continuous stream synthesis technique of phenylhydrazine salt and substituted benzene hydrazonium salt 上海惠和化德生物科技有限公司 2018-02-06 CN disclosed
CN-105272877-A Preparation method of 3-chlorophenylhydrazine phosphate TIANJIN CHEM REAGENT RES INST 2016-01-27 CN disclosed