SCHEMBL4013841

SCHEMBL4013841

Cc1cc(C)c(C#N)c(S(=O)(=O)Cl)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.51
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
ALDH1A1 P00352 9/20 0.47
HPGD P15428 4/20 0.44
HSD17B10 Q99714 3/20 0.44
RECQL P46063 2/20 0.44
MAPT P10636 2/20 0.43
PKM P14618 2/20 0.43
TSHR P16473 5/20 0.42
MAPK1 P28482 2/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
POLB P06746 1/20 0.41
KHK P50053 1/20 0.41
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL4012374 0.83 KDM4E (0.56) KDM4EKMT2AMEN1ALDH1A1HPGD
SCHEMBL2927253 0.72 LMNA (0.37) KDM4EKMT2AMEN1ALDH1A1HPGD
SCHEMBL318407 0.72 KDM4E (0.60) KDM4EKMT2AMEN1ALDH1A1HPGD
SCHEMBL29420807 0.72 KDM4E (0.60) KDM4EKMT2AMEN1ALDH1A1HPGD
SCHEMBL4066614 0.71 KDM4E (0.64) KDM4EKMT2AMEN1ALDH1A1HPGD
SCHEMBL9760147 0.71 KDM4E (0.56) KDM4EKMT2AMEN1ALDH1A1HPGD
SCHEMBL3018446 0.70 CYP1A2 (0.59) KDM4EKMT2AMEN1ALDH1A1HPGD
SCHEMBL10288069 0.68 KDM4E (0.60) KDM4EKMT2AMEN1ALDH1A1HPGD
SCHEMBL4327152 0.68 KDM4E (0.60) KDM4EKMT2AMEN1ALDH1A1HPGD
SCHEMBL2673578 0.68 KDM4E (0.60) KDM4EKMT2AMEN1ALDH1A1HPGD

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-1915344-B1 CYANOPYRIDINE PESTICIDES BASF SE (DE) 2009-07-01 EP disclosed