SCHEMBL9729048

SCHEMBL9729048

CCc1cc(Oc2c(F)c(F)c(F)c(F)c2F)ccc1CNc1ncnc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.50
NR2F2 P24468 3/20 0.50
POLB P06746 1/20 0.50
GALR3 O60755 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 5/20 0.44
LMNA P02545 3/20 0.44
TSHR P16473 3/20 0.44
MAPK1 P28482 2/20 0.44
HTT P42858 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
LDHA P00338 1/20 0.43
ALDH1A1 P00352 3/20 0.43
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
HSD17B10 Q99714 2/20 0.43
CLK4 Q9HAZ1 2/20 0.43

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
SCHEMBL9215331 0.72 NR2F2 (0.45) EGFRNR2F2POLBGALR3RAB9A
SCHEMBL4866306 0.72 CYP1A2 (0.73) EGFRNR2F2POLBSMN1; SMN2LMNA
SCHEMBL4864339 0.72 EGFR (0.67) EGFRNR2F2POLBSMN1; SMN2LMNA
SCHEMBL20399102 0.68 EGFR (0.56) EGFRNR2F2POLBGALR3RAB9A
SCHEMBL4859108 0.67 MAPK1 (0.76) EGFRNR2F2POLBSMN1; SMN2LMNA
SCHEMBL3112115 0.67 EGFR (1.00) EGFRNR2F2POLBGALR3RAB9A
SCHEMBL15923256 0.67 EGFR (0.70) EGFRNR2F2POLBGALR3RAB9A
SCHEMBL11255358 0.67 LDHA (0.65) EGFRNR2F2POLBGALR3RAB9A
SCHEMBL10061697 0.67 SMN1; SMN2 (0.67) EGFRNR2F2POLBGALR3RAB9A
SCHEMBL4865169 0.66 EGFR (0.78) EGFRNR2F2POLBGALR3RAB9A

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-5141941-A ARALKYLAMINE DERIVATIVES, AND FUNGICIDES CONTAINING THE SAME UBE INDUSTRIES, LTD. (JP) 1992-08-25 US disclosed