SCHEMBL8428186

SCHEMBL8428186

O=C(N=C1SC(Cl)CN1c1cccc(C(F)(F)F)c1)C(F)Cl

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.40
ACACB O00763 2/20 0.37
POLB P06746 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
DRD2 P14416 2/20 0.35
DRD3 P35462 2/20 0.35
TSHR P16473 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYP17A1 P05093 1/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KCNH2 Q12809 1/20 0.34
TRPV1 Q8NER1 1/20 0.34

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
SCHEMBL8424321 0.93 NOTUM (0.41) NOTUMACACBPOLBMEN1KMT2A
SCHEMBL8425467 0.93 NOTUM (0.41) NOTUMACACBPOLBMEN1KMT2A
SCHEMBL8423614 0.89 NOTUM (0.40) NOTUMACACBPOLBMEN1KMT2A
SCHEMBL8428411 0.88 NOTUM (0.39) NOTUMACACBPOLBMEN1KMT2A
SCHEMBL8423325 0.88 NOTUM (0.39) NOTUMACACBPOLBMEN1KMT2A
SCHEMBL8424061 0.86 NOTUM (0.38) NOTUMACACBPOLBSMN1; SMN2DRD2
SCHEMBL8424243 0.80 NOTUM (0.41) NOTUMACACBPOLBMEN1KMT2A
SCHEMBL8425558 0.80 NOTUM (0.41) NOTUMACACBPOLBMEN1KMT2A
SCHEMBL8425854 0.80 NOTUM (0.41) NOTUMACACBPOLBMEN1KMT2A
SCHEMBL8425728 0.80 NOTUM (0.41) NOTUMACACBPOLBMEN1KMT2A

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-0636616-B1 Process for production of fluoroalkanecarboxamide derivatives SUMITOMO CHEMICAL CO (JP) 1999-10-27 EP disclosed
US-5484933-A Process for production of fluoroalkane carboxamide derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-01-16 US disclosed
EP-0636616-A1 Process for production of fluoroalkanecarboxamide derivatives SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-02-01 EP disclosed