SCHEMBL7467852

SCHEMBL7467852

Fc1ccc(Nc2nccc(-c3ccncc3)n2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 4/20 0.65
PIK3CG P48736 4/20 0.65
PIK3CB P42338 3/20 0.65
NPC1 O15118 2/20 0.59
MAPT P10636 2/20 0.59
RAB9A P51151 2/20 0.59
SYK P43405 1/20 0.59
MEN1 O00255 1/20 0.59
LMNA P02545 1/20 0.59
ALOX12 P18054 1/20 0.59
MAPK1 P28482 1/20 0.59
KMT2A Q03164 1/20 0.59
ABL1 P00519 4/20 0.58
BCR P11274 3/20 0.58
SRC P12931 1/20 0.58
CAMK2D Q13557 1/20 0.58
POLB P06746 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
CDK2 P24941 4/20 0.56

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
SCHEMBL7470313 0.84 ABL1 (0.58) PIK3CAPIK3CGPIK3CBNPC1MAPT
SCHEMBL7470875 0.84 PLK1 (0.63) PIK3CAPIK3CGPIK3CBSYKABL1
SCHEMBL4903317 0.84 ABL1 (0.70) PIK3CAPIK3CGPIK3CBNPC1MAPT
SCHEMBL4029958 0.84 ABL1 (0.72) PIK3CGNPC1MAPTRAB9AMAPK1
SCHEMBL16941489 0.84 ABL1 (0.61) PIK3CAPIK3CGPIK3CBABL1BCR
SCHEMBL7461475 0.84 ABL1 (0.76) PIK3CAPIK3CGPIK3CBNPC1MAPT
SCHEMBL7472770 0.83 ABL1 (0.67) PIK3CAPIK3CGPIK3CBABL1BCR
SCHEMBL7468539 0.82 ABL1 (0.71) PIK3CAPIK3CGPIK3CBABL1BCR
SCHEMBL7470657 0.82 IKBKB (0.67) PIK3CAPIK3CGPIK3CBNPC1MAPT
SCHEMBL7465536 0.81 ABL1 (0.54) PIK3CAPIK3CGPIK3CBNPC1RAB9A

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-0233461-B2 4,5,6-Substituted-2-pyrimidinamines AMERICAN CYANAMID CO (US) 2002-05-29 EP disclosed