SCHEMBL4778467

SCHEMBL4778467

CNC(=O)N(F)c1ccc(SC(F)(F)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.42
TRPV1 Q8NER1 1/20 0.41
PTPRZ1 P23471 2/20 0.41
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
EPHX2 P34913 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
PTPN1 P18031 1/20 0.39
KCNK2 O95069 8/20 0.38
KCNK10 P57789 6/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPK1 P28482 2/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
KIT P10721 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
SCHEMBL5490024 0.73 L3MBTL1 (0.42) ALDH1A1TDP1NPC1RAB9ASMN1; SMN2
SCHEMBL6497474 0.73 PLK1 (0.61) KIF11TRPV1PTPRZ1EPHX2NR1H4
SCHEMBL5481193 0.70 ROCK2 (0.30)
SCHEMBL20328053 0.70 MMP2 (0.36) KIF11TRPV1PTPRZ1ALDH1A1PTPN1
SCHEMBL4726846 0.70 KIF11 (0.51) KIF11TRPV1PTPRZ1ALDH1A1KDM4E
SCHEMBL11755915 0.69 ALDH1A1 (0.52) KIF11PTPRZ1ALDH1A1KDM4ETDP1
SCHEMBL11731759 0.69 KIF11 (0.58) KIF11TRPV1ALDH1A1NPC1RAB9A
SCHEMBL4149723 0.69 TSHR (0.38) KIF11TRPV1PTPRZ1ALDH1A1EPHX2
SCHEMBL11777920 0.67 KIF11 (0.51) KIF11TRPV1ALDH1A1KDM4EEPHX2
SCHEMBL11778655 0.67 TRPV1 (0.57) KIF11TRPV1PTPRZ1ALDH1A1EPHX2

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-1937629-A2 BENZOYLUREA COMPOUNDS AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2008-07-02 EP disclosed
WO-2007046513-A2 BENZOYLUREA COMPOUNDS AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-26 WO disclosed