SCHEMBL9717151

SCHEMBL9717151

NNc1ccc(-c2ccc(NN)cc2Cl)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
KDM4E B2RXH2 1/20 0.48
NPC1 O15118 1/20 0.48
POLB P06746 1/20 0.48
RAB9A P51151 1/20 0.48
IDO1 P14902 3/20 0.39
GAA P10253 2/20 0.38
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
PTGS2 P35354 1/20 0.36
EPHX1 P07099 1/20 0.35
EPHX2 P34913 1/20 0.35
GLA P06280 1/20 0.35
ESR1 P03372 2/20 0.34
ESR2 Q92731 2/20 0.34

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
SCHEMBL833283 0.82 MAPT (0.55) MAPTTDP1KDM4ENPC1POLB
SCHEMBL29502263 0.82 MAPT (0.55) MAPTTDP1KDM4ENPC1POLB
Hydrochloric Acid SCHEMBL629175 0.80 MAPT (0.53) MAPTTDP1KDM4ENPC1POLB
SCHEMBL11942144 0.76 CA2 (0.52) MAPTTDP1KDM4ENPC1POLB
SCHEMBL3539117 0.76 MAPT (0.50) MAPTTDP1KDM4ENPC1POLB
SCHEMBL1143502 0.76 RAPGEF4 (0.55) MAPTTDP1KDM4ENPC1POLB
SCHEMBL18155423 0.76 MAPT (0.46) MAPTTDP1KDM4ENPC1POLB
SCHEMBL670295 0.76 MEN1 (0.57) MAPTTDP1KDM4ENPC1POLB
SCHEMBL9823483 0.76 MAPT (0.52) MAPTTDP1KDM4ENPC1POLB
SCHEMBL9717234 0.75 KDM4E (0.43) MAPTTDP1KDM4ENPC1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5091466-A Insolubilization of soluble pre-imidized polyimides by polyhydrazine compounds GENERAL ELECTRIC COMPANY (US) 1992-02-25 US disclosed