SCHEMBL9215331

SCHEMBL9215331

CCC(Nc1ncnc2ccccc12)c1ccc(Oc2c(F)c(F)c(F)c(F)c2F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR2F2 P24468 2/20 0.45
GALR3 O60755 1/20 0.45
EGFR P00533 5/20 0.44
KDR P35968 1/20 0.44
TEK Q02763 1/20 0.44
LMNA P02545 2/20 0.43
RPS6KB1 P23443 3/20 0.43
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
HTT P42858 2/20 0.40
LDHA P00338 1/20 0.39
ITGB1 P05556 1/20 0.39
ITGA4 P13612 1/20 0.39
GAA P10253 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL9728774 0.82 EGFR (0.38) EGFRLMNARPS6KB1
SCHEMBL9729031 0.79 EGFR (0.36) EGFRLMNARPS6KB1
SCHEMBL9212072 0.78 EGFR (0.36) EGFRRPS6KB1
SCHEMBL9729048 0.72 EGFR (0.50) NR2F2GALR3EGFRLMNAPOLB
SCHEMBL9212840 0.72 ALDH1A1 (0.35) EGFRRPS6KB1
SCHEMBL9208274 0.71 PIK3CD (0.34) EGFRRPS6KB1
SCHEMBL13283199 0.69 GALR3 (0.63) NR2F2GALR3EGFRLMNAPOLB
SCHEMBL4572178 0.69 GALR3 (0.63) NR2F2GALR3EGFRLMNAPOLB
SCHEMBL9729004 0.68 IDH1 (0.39) NR2F2GALR3EGFRKDR
SCHEMBL8504743 0.67 GALR3 (0.61) NR2F2GALR3EGFRLMNARPS6KB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0370704-B1 Aralkylamine derivatives, preparation thereof and fungicides containing the same UBE INDUSTRIES (JP) 1995-02-01 EP disclosed
EP-0370704-A2 Aralkylamine derivatives, preparation thereof and fungicides containing the same UBE INDUSTRIES, LTD. (JP) 1990-05-30 EP disclosed