SCHEMBL8761114

SCHEMBL8761114

CC(=O)C(Cl)=Cc1cc(-n2c(=O)[nH]c(C(F)(F)F)c(C)c2=O)ccc1Cl

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.34
TP53 P04637 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 2/20 0.31
NSD2 O96028 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
PKM P14618 1/20 0.31
APEX1 P27695 1/20 0.31
CASP3 P42574 1/20 0.31
RECQL P46063 1/20 0.31
CASP6 P55212 1/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
CTSB P07858 1/20 0.30

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
SCHEMBL8761988 0.88 NOTUM (0.31) NOTUMTP53HTT
SCHEMBL8762288 0.83 LMNA (0.33)
SCHEMBL8612848 0.79 TP53 (0.34) NOTUMTP53HTTALDH1A1L3MBTL1
SCHEMBL8762018 0.75 KDM4E (0.36) NOTUMALDH1A1SMN1; SMN2
SCHEMBL8612939 0.73 NOTUM (0.32) NOTUMTP53HTT
SCHEMBL7927759 0.72 BCAT1 (0.42) NOTUMHTTALDH1A1SMN1; SMN2
SCHEMBL7530294 0.72 NOTUM (0.33) NOTUM
SCHEMBL7927757 0.72 BCAT1 (0.42) NOTUMHTTALDH1A1SMN1; SMN2
SCHEMBL7530298 0.72 NOTUM (0.33) NOTUM
SCHEMBL7930382 0.71 BCAT1 (0.42) HTTALDH1A1SMN1; SMN2

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-0770067-A1 SUBSTITUTED CINNAMIC OXIME AND HYDROXAMIDE DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 1997-05-02 EP disclosed
WO-1996002518-A1 SUBSTITUTED CINNAMIC OXIME AND HYDROXAMIDE DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 1996-02-01 WO disclosed