SCHEMBL9979598

SCHEMBL9979598

CO/N=C\c1ccc(-c2ccccc2NC(=O)c2c(C)nn(C)c2Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.45
ALDH1A1 P00352 6/20 0.43
HPGD P15428 3/20 0.43
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPT P10636 2/20 0.38
GAA P10253 1/20 0.38
ATM Q13315 1/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 2/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
HTT P42858 1/20 0.38
NR3C1 P04150 1/20 0.38

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
SCHEMBL14578089 0.91 LMNA (0.43) LMNAALDH1A1HPGDKMT2AMEN1
SCHEMBL14578333 0.90 SMN1; SMN2 (0.41) LMNAALDH1A1HPGDKMT2AMEN1
SCHEMBL5119902 0.88 ALDH1A1 (0.42) LMNAALDH1A1HPGDKMT2AMEN1
SCHEMBL5119905 0.88 ALDH1A1 (0.42) LMNAALDH1A1HPGDKMT2AMEN1
SCHEMBL14578189 0.88 NR3C1 (0.41) LMNAALDH1A1HPGDKMT2AMEN1
SCHEMBL14578372 0.88 ALDH1A1 (0.38) LMNAALDH1A1HPGDKMT2AMEN1
SCHEMBL9979546 0.88 L3MBTL1 (0.47) ALDH1A1HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL9979545 0.86 NR3C1 (0.43) LMNAALDH1A1HPGDKMT2AMEN1
SCHEMBL14578373 0.86 CHRM3 (0.39) LMNAALDH1A1KMT2AL3MBTL1KDM4E
SCHEMBL9979664 0.84 LMNA (0.45) LMNAALDH1A1HPGDKMT2AMEN1

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