SCHEMBL7861719

SCHEMBL7861719

N#Cc1c(F)c(F)c(Nc2ccc(Cl)cc2Cl)c(F)c1C#N

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 3/20 0.49
SRC P12931 12/20 0.42
ABL1 P00519 1/20 0.42
BCR P11274 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
TAS1R2 Q8TE23 1/20 0.40
PRKCQ Q04759 1/20 0.40
MAPK1 P28482 1/20 0.37
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36
CA1 P00915 1/20 0.36
CA14 Q9ULX7 1/20 0.36

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
SCHEMBL14325888 0.91 MAP2K1 (0.49) MAP2K1SRCABL1BCRTAS1R3
SCHEMBL14315663 0.90 MAP2K1 (0.48) MAP2K1SRCABL1BCRTAS1R3
SCHEMBL7873558 0.81 MAPK1 (0.47) SRCTAS1R3TAS1R1TAS1R2MAPK1
SCHEMBL14325897 0.78 MAP2K1 (0.51) MAP2K1SRCABL1BCRTAS1R3
SCHEMBL14318553 0.78 MAP2K1 (0.51) MAP2K1SRCABL1BCRTAS1R3
SCHEMBL7868431 0.78 MAPT (0.44) MAP2K1SRCPRKCQ
SCHEMBL16386494 0.77 MAP2K1 (0.50) MAP2K1SRCABL1BCRTAS1R3
SCHEMBL14325894 0.77 SRC (0.49) MAP2K1SRCABL1BCRTAS1R3
SCHEMBL14325893 0.77 SRC (0.44) MAP2K1SRCMAPK1EGFR
SCHEMBL14315679 0.75 SRC (0.43) MAP2K1SRCMAPK1EGFR

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
EP-0882768-B1 Method for producing of phthalocyanine compound NIPPON CATALYTIC CHEM IND (JP) 2001-12-19 EP disclosed
US-6034236-A REACTING A PHTHALONITRILE WITH A METAL OXIDE IN PRESENCE OF A SULFONIC ACID CATALYST NIPPON SHOKUBAI CO., LTD. (JP) 2000-03-07 US disclosed
EP-0882768-A2 Method for producing of phthalocyanine compound NIPPON SHOKUBAI CO., LTD. (JP) 1998-12-09 EP disclosed