SCHEMBL8107032

SCHEMBL8107032

CCC(=O)c1c(C)ccc(F)c1N

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
CYP3A4 P08684 1/20 0.36
PTGS1 P23219 1/20 0.36
DRD3 P35462 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 3/20 0.35
ALDH1A1 P00352 6/20 0.33
HPGD P15428 3/20 0.33
HSD17B10 Q99714 2/20 0.33
KDM4E B2RXH2 2/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 4/20 0.33
ALOX15 P16050 2/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPC1 O15118 1/20 0.32
PKM P14618 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL3642705 0.79 KMT2A (0.38) MEN1CYP3A4KMT2AKDM4EMAPT
SCHEMBL16490936 0.79 HSD17B10 (0.39) MEN1KMT2AALDH1A1HPGDHSD17B10
SCHEMBL17825685 0.79 POLB (0.36) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL15353466 0.75 CA12 (0.41) MEN1CYP3A4KMT2ATSHRALDH1A1
SCHEMBL14454136 0.74 CES2 (0.48) MEN1CYP3A4PTGS1DRD3KMT2A
SCHEMBL22548778 0.74 MAPT (0.34) KDM4EMAPTHDAC1HDAC6TDP1
SCHEMBL9720595 0.71 KMT2A (0.47) MEN1CYP3A4PTGS1DRD3KMT2A
SCHEMBL23658405 0.70 POLB (0.30)
SCHEMBL13181078 0.70 CES2 (0.48) MEN1CYP3A4PTGS1DRD3KMT2A
SCHEMBL1275288 0.70 GSK3B (0.39) CYP3A4KMT2AALDH1A1HPGDKDM4E

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-0973751-A1 PHENYL-AMINO-SULFONYL-UREA DERIVATIVES AS FUNGICIDES AND PESTICIDES BAYER AG (DE) 2000-01-26 EP disclosed
WO-1998038172-A1 PHENYL-AMINO-SULFONYL-UREA DERIVATIVES AS FUNGICIDES AND PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1998-09-03 WO disclosed