SCHEMBL14517971

SCHEMBL14517971

Cc1nc(C(F)(F)F)c(C(=O)Nc2ccccc2-c2ccc3c(c2)OC(F)(F)O3)s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.42
▸ HTT P42858 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ POLQ O75417 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ SCN9A Q15858 1/20 0.39
▸ TP53 P04637 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ WDR5 P61964 1/20 0.38
▸ USP2 O75604 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ NTRK1 P04629 1/20 0.36
▸ HSD11B1 P28845 1/20 0.36
▸ ABCG2 Q9UNQ0 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
SCHEMBL14517997 0.95 MAPT (0.41) MAPTHTTKDM4ESMN1; SMN2TDP1
SCHEMBL12920787 0.83 MAPT (0.46) MAPTHTTKDM4ESMN1; SMN2TDP1
SCHEMBL9225609 0.83 MAPT (0.54) MAPTHTTKDM4ESMN1; SMN2TDP1
SCHEMBL557468 0.82 MAPT (0.45) MAPTHTTKDM4ESMN1; SMN2TDP1
SCHEMBL14564436 0.82 MAPT (0.45) MAPTHTTKDM4ESMN1; SMN2TDP1
SCHEMBL13210783 0.82 NTRK1 (0.51) MAPTHTTKDM4ESMN1; SMN2TDP1
SCHEMBL14564442 0.82 MAPT (0.44) MAPTHTTKDM4ESMN1; SMN2TDP1
SCHEMBL14564507 0.82 CHRM3 (0.47) MAPTHTTKDM4ESMN1; SMN2TDP1
SCHEMBL14564410 0.82 MAPT (0.44) MAPTHTTKDM4ESMN1; SMN2TDP1
SCHEMBL12212660 0.81 MAPT (0.54) MAPTHTTKDM4ESMN1; SMN2TDP1

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
US-7208169-B2 Biphenyl carboxamides BAYER CROPSCIENCE LP (DE) 2007-04-24 — — US disclosed
US-7208169-B2 Biphenyl carboxamides BAYER CROPSCIENCE LP (DE) 2007-04-24 — — US disclosed
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