SCHEMBL8424304

SCHEMBL8424304

CCC1CN(c2cccc(C(F)(F)F)c2)C(=NC(=O)C(F)C(F)(F)F)S1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.39
ACACB O00763 3/20 0.38
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CNR2 P34972 1/20 0.36
POLB P06746 3/20 0.36
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
KDM4E B2RXH2 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL8424561 0.94 NOTUM (0.39) NOTUMACACBLMNASMN1; SMN2CNR2
SCHEMBL8423932 0.93 ACACB (0.39) NOTUMACACBLMNASMN1; SMN2CNR2
SCHEMBL8424061 0.92 NOTUM (0.38) NOTUMACACBLMNASMN1; SMN2CNR2
SCHEMBL9246844 0.87 ACACB (0.39) NOTUMACACBLMNASMN1; SMN2CNR2
SCHEMBL8425728 0.86 NOTUM (0.41) NOTUMACACBLMNACNR2POLB
SCHEMBL9369859 0.85 ACACB (0.40) NOTUMACACBLMNASMN1; SMN2POLB
SCHEMBL9369347 0.85 ACACB (0.42) NOTUMACACBLMNASMN1; SMN2POLB
SCHEMBL8425854 0.84 NOTUM (0.41) NOTUMACACBLMNASMN1; SMN2CNR2
SCHEMBL8424321 0.84 NOTUM (0.41) NOTUMACACBLMNASMN1; SMN2POLB
SCHEMBL9064116 0.84 NOTUM (0.38) NOTUMACACBLMNASMN1; SMN2CNR2

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-0636616-B1 Process for production of fluoroalkanecarboxamide derivatives SUMITOMO CHEMICAL CO (JP) 1999-10-27 EP disclosed
EP-0636616-A1 Process for production of fluoroalkanecarboxamide derivatives SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-02-01 EP disclosed