SCHEMBL14819986

SCHEMBL14819986

CCC(=O)N(C)c1ccc(SC(F)(F)F)cc1F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
PTPRZ1 P23471 2/20 0.34
PDE2A O00408 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
PPARG P37231 1/20 0.33
EPHX2 P34913 1/20 0.33
NR1H4 Q96RI1 1/20 0.33
KCNK2 O95069 2/20 0.32
KCNK10 P57789 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
KIF11 P52732 1/20 0.32
PDK2 Q15119 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
MCHR1 Q99705 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PTPN1 P18031 1/20 0.31

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
SCHEMBL3618932 0.84 FSCN1 (0.44) TSHRLMNAMAPTMAPK1HTT
SCHEMBL4154186 0.83 LMNA (0.37) TSHRLMNAMAPTMAPK1HTT
SCHEMBL4142022 0.83 PTPRZ1 (0.37) TSHRLMNAMAPTMAPK1HTT
SCHEMBL4149723 0.81 TSHR (0.38) TSHRLMNAMAPTMAPK1HTT
SCHEMBL4142460 0.80 LMNA (0.35) TSHRLMNAMAPTMAPK1HTT
SCHEMBL4150851 0.79 PTPRZ1 (0.36) TSHRLMNAMAPTMAPK1HTT
SCHEMBL4158539 0.77 MAPT (0.36) TSHRLMNAMAPTMAPK1HTT
SCHEMBL4149940 0.77 PTPRZ1 (0.35) TSHRLMNAMAPTMAPK1HTT
SCHEMBL4144820 0.77 PTPRZ1 (0.35) TSHRLMNAMAPTMAPK1HTT
SCHEMBL4149965 0.77 ACKR3 (0.38) MAPK1HTTPTPRZ1EPHX2NR1H4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2174929-B1 4-(TRICHLOROMETHYLTHIO)ANILINE, METHOD FOR PRODUCING THE SAME, AND METHOD FOR PRODUCING 4-(TRIFLUOROMETHYLTHIO)ANILINE SUMITOMO CHEMICAL CO (JP) 2013-03-27 EP disclosed