SCHEMBL9979529

SCHEMBL9979529

CCO/N=C/c1ccc(-c2ccccc2NC(=O)c2cn(C)nc2C(F)(F)F)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
POLB P06746 1/20 0.45
ALDH1A1 P00352 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
NTRK1 P04629 3/20 0.41
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
ATM Q13315 1/20 0.38
GAA P10253 1/20 0.37
CHRM3 P20309 1/20 0.37
WDR5 P61964 2/20 0.37
STING1 Q86WV6 1/20 0.37
IRAK4 Q9NWZ3 2/20 0.37
GLA P06280 1/20 0.36
DGAT1 O75907 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
SCHEMBL9979541 0.93 LMNA (0.44) LMNAPOLBALDH1A1L3MBTL1NTRK1
SCHEMBL13215978 0.92 LMNA (0.43) LMNAPOLBALDH1A1L3MBTL1NTRK1
SCHEMBL14578270 0.91 LMNA (0.43) LMNAPOLBALDH1A1L3MBTL1NTRK1
SCHEMBL9979547 0.91 LMNA (0.47) LMNAPOLBALDH1A1L3MBTL1NTRK1
SCHEMBL14578389 0.91 LMNA (0.47) LMNAPOLBALDH1A1L3MBTL1NTRK1
SCHEMBL13215923 0.89 LMNA (0.42) LMNAPOLBNTRK1CHRM3WDR5
SCHEMBL9979697 0.88 LMNA (0.47) LMNAPOLBALDH1A1L3MBTL1NTRK1
SCHEMBL9979682 0.88 LMNA (0.49) LMNAPOLBALDH1A1L3MBTL1NTRK1
SCHEMBL9979539 0.87 ATM (0.53) LMNAPOLBALDH1A1L3MBTL1KDM4E
SCHEMBL9979542 0.85 LMNA (0.50) LMNAPOLBALDH1A1L3MBTL1NTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1305292-B1 BIPHENYL CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2012-06-20 EP disclosed
US-7176228-B2 Pyrazole biphenylcarboxamides BAYER CROPSCIENCE AG (DE) 2007-02-13 US disclosed
US-7176228-B2 Pyrazole biphenylcarboxamides BAYER CROPSCIENCE AG (DE) 2007-02-13 US disclosed