SCHEMBL6689669

SCHEMBL6689669

Cc1nc(C(F)F)c(C(=O)Nc2cc(F)ccc2-c2cccc(Cl)c2)s1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.40
MAPT P10636 3/20 0.40
THRB P10828 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
CYP3A4 P08684 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TP53 P04637 1/20 0.38
RORC P51449 1/20 0.38
MAPK1 P28482 1/20 0.37
CHRM3 P20309 3/20 0.37
CHRM1 P11229 2/20 0.37
CHRM2 P08172 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
JAK2 O60674 1/20 0.37
F10 P00742 1/20 0.37
CTSV O60911 1/20 0.36

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
SCHEMBL3795460 0.92 SMN1; SMN2 (0.40) KMT2AMAPTL3MBTL1CYP3A4CYP1A2
SCHEMBL13210784 0.89 KMT2A (0.42) KMT2AMAPTL3MBTL1CYP3A4SMN1; SMN2
SCHEMBL12424046 0.80 CHRM3 (0.44) MAPTTHRBCYP3A4CYP1A2CYP2C19
SCHEMBL2906748 0.80 CHRNA7 (0.47) KMT2AMAPTCHRM3
SCHEMBL4352723 0.79 RAB9A (0.42) KMT2AMAPTLMNASMN1; SMN2TP53
SCHEMBL12424057 0.79 CHRM3 (0.44) MAPTTHRBCYP3A4CYP1A2CYP2C19
SCHEMBL12424052 0.79 MAPT (0.40) KMT2AMAPTTHRBCYP3A4CYP1A2
SCHEMBL13210721 0.79 NTRK1 (0.43) KMT2AMAPTTHRBLMNASMN1; SMN2
SCHEMBL343339 0.78 TDP1 (0.47) KMT2AMAPTTHRBL3MBTL1RXFP1
SCHEMBL29437135 0.78 RAB9A (0.41) KMT2AMAPTL3MBTL1SMN1; SMN2

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-1474407-A1 DIFLUOROMETHYL THIAZOLYL CARBOXANILIDES Bayer CropScience AG (DE) 2004-11-10 EP disclosed
WO-2003066610-A1 DIFLUOROMETHYL THIAZOLYL CARBOXANILIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-08-14 WO disclosed