SCHEMBL21921291

SCHEMBL21921291

Cc1ccc(N=Nc2ccc(C)cc2C(F)(F)F)c(C(F)(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.41
RAB9A P51151 5/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
SYK P43405 1/20 0.39
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
MAPT P10636 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ATM Q13315 2/20 0.37
PKM P14618 1/20 0.37
MAPK1 P28482 1/20 0.37
AR P10275 3/20 0.37
HSP90AA1 P07900 1/20 0.37
KIF11 P52732 1/20 0.35
FTO Q9C0B1 1/20 0.35
LMNA P02545 1/20 0.35
RAC1 P63000 1/20 0.34
PAK1 Q13153 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
CYP3A4 P08684 2/20 0.33

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
SCHEMBL12509626 0.83 SMN1; SMN2 (0.38) NPC1RAB9ASMN1; SMN2SYKMEN1
SCHEMBL21426610 0.80 IGF1R (0.38) NPC1RAB9AMEN1KMT2AATM
SCHEMBL22604906 0.79 PDE2A (0.38) SMN1; SMN2SYKARKIF11RAC1
SCHEMBL11726779 0.79 SMN1; SMN2 (0.35) NPC1RAB9ASMN1; SMN2SYKMEN1
SCHEMBL1783029 0.79 CYP3A4 (0.41) RAB9ASMN1; SMN2SYKMAPTATM
SCHEMBL11882983 0.79 RAC1 (0.46) SMN1; SMN2SYKMAPTARLMNA
SCHEMBL4273522 0.77 SMN1; SMN2 (0.45) SMN1; SMN2SYKARKIF11FFAR4
SCHEMBL4634620 0.76 IDO1 (0.44) NPC1RAB9AMEN1KMT2AAR
SCHEMBL4634614 0.76 IDO1 (0.44) NPC1RAB9AMEN1KMT2AAR
SCHEMBL10030392 0.75 GLA (0.54) SMN1; SMN2SYKARKIF11FFAR4

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-20200096825-A1 LIQUID CRYSTAL DISPLAY SHARP KABUSHIKI KAISHA (JP) 2020-03-26 US disclosed