SCHEMBL14647707

SCHEMBL14647707

Bc1cnc(N)c(OCc2ccc(F)cc2Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.44
PTGER1 P34995 3/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
MET P08581 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
ALOX15 P16050 2/20 0.40
HSD17B10 Q99714 2/20 0.40
ALDH1A1 P00352 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MAP4K3 Q8IVH8 1/20 0.40
INPPL1 O15357 2/20 0.39
JAK2 O60674 3/20 0.38
JAK1 P23458 1/20 0.38
TYK2 P29597 1/20 0.38
JAK3 P52333 1/20 0.38
LMNA P02545 1/20 0.38
HTR2C P28335 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
SCHEMBL488774 0.84 MET (0.46) RAB9APTGER1CYP1A2CYP3A4CYP2C9
SCHEMBL487833 0.82 JAK2 (0.58) RAB9APTGER1CYP1A2CYP3A4CYP2C9
SCHEMBL487782 0.81 MET (0.65) RAB9APTGER1CYP1A2CYP3A4CYP2C9
SCHEMBL30453255 0.81 MET (0.65) RAB9APTGER1CYP1A2CYP3A4CYP2C9
SCHEMBL488182 0.80 RAB9A (0.58) RAB9APTGER1CYP1A2CYP3A4CYP2C9
SCHEMBL27630151 0.77 MET (0.48) RAB9AMETMAP4K3INPPL1JAK2
SCHEMBL30452968 0.77 MAP4K4 (0.64) METJAK2
SCHEMBL487734 0.77 MAP4K4 (0.64) METJAK2
SCHEMBL29118568 0.75 ALDH1A1 (0.48) RAB9APTGER1CYP1A2CYP3A4CYP2C9
SCHEMBL29857597 0.74 MET (0.48) RAB9ACYP3A4METMAP4K3JAK2

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
EP-1603570-B1 AMINOHETEROARYL COMPOUNDS AS PROTEIN KINASE INHIBITORS SUGEN INC (US) 2013-01-23 EP disclosed