SCHEMBL9208342

SCHEMBL9208342

CC(Nc1ncnc2sccc12)c1ccc(Oc2c(F)c(F)c(F)c(F)c2F)cc1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.63
TNF P01375 1/20 0.63
NOD1 Q9Y239 1/20 0.63
EGFR P00533 8/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
NPC1 O15118 3/20 0.46
FDPS P14324 1/20 0.44
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL22862812 0.83 RAB9A (0.72) RAB9ATNFNOD1EGFRMEN1
SCHEMBL29490326 0.83 RAB9A (0.72) RAB9ATNFNOD1EGFRMEN1
SCHEMBL22862863 0.80 RAB9A (0.78) RAB9ATNFNOD1EGFRMEN1
SCHEMBL22862473 0.80 RAB9A (0.78) RAB9ATNFNOD1EGFRMEN1
SCHEMBL9729816 0.79 EGFR (0.40) RAB9ATNFNOD1EGFRLMNA
SCHEMBL22862472 0.78 RAB9A (0.76) RAB9ATNFNOD1EGFRMEN1
SCHEMBL22862865 0.78 RAB9A (0.76) RAB9ATNFNOD1EGFRMEN1
SCHEMBL22862521 0.78 RAB9A (0.76) RAB9ATNFNOD1EGFRMEN1
SCHEMBL22862813 0.78 RAB9A (0.76) RAB9ATNFNOD1EGFRMEN1
SCHEMBL22862834 0.78 RAB9A (0.76) RAB9ATNFNOD1EGFRMEN1

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 3 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
US-5141941-A ARALKYLAMINE DERIVATIVES, AND FUNGICIDES CONTAINING THE SAME UBE INDUSTRIES, LTD. (JP) 1992-08-25 US disclosed
EP-0370704-A2 Aralkylamine derivatives, preparation thereof and fungicides containing the same UBE INDUSTRIES, LTD. (JP) 1990-05-30 EP disclosed