SCHEMBL28045561

SCHEMBL28045561

O=P(O)(O)NNc1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 6/20 0.52
GAA P10253 7/20 0.44
ALDH1A1 P00352 6/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
ALOX12 P18054 1/20 0.44
CYP2C19 P33261 1/20 0.44
CA2 P00918 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
MMP14 P50281 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
LMNA P02545 3/20 0.42
AGTR1 P30556 2/20 0.42
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NPC1 O15118 2/20 0.42
POLB P06746 1/20 0.41

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
SCHEMBL20985042 0.78 CA12 (0.52) GAAALDH1A1CYP1A2CYP3A4ALOX12
SCHEMBL20984530 0.78 MMP2 (0.52) GAAALDH1A1CA2MMP2MMP9
SCHEMBL20984210 0.77 ALDH1A1 (0.50) PTGS2GAAALDH1A1CYP3A4CA2
SCHEMBL915097 0.77 MMP2 (0.46) PTGS2ALDH1A1CYP1A2CYP2C19CA2
SCHEMBL20984061 0.76 MAPT (0.52) GAAALDH1A1LMNAMAPTNPC1
SCHEMBL20984499 0.74 ALDH1A1 (0.42) ALDH1A1TDP1
SCHEMBL20984418 0.74 PTGS2 (0.51) PTGS2GAAALDH1A1CA2MAPT
SCHEMBL28381021 0.74 MMP2 (0.58) ALDH1A1CA2MMP2CA9CA14
SCHEMBL20984611 0.74 SRC (0.56) GAAALDH1A1ALOX12CYP2C19LMNA
SCHEMBL20984638 0.74 CA1 (0.56) CA2MMP2LMNANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105272875-A 4-chlorophenylhydrazine phosphate preparation method TIANJIN CHEM REAGENT RES INST 2016-01-27 CN disclosed
CN-105272875-A 4-chlorophenylhydrazine phosphate preparation method TIANJIN CHEM REAGENT RES INST 2016-01-27 CN disclosed