SCHEMBL8704902

SCHEMBL8704902

CS(=O)(=O)Nc1ccccc1C(=O)CCl

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.61
ALDH1A1 P00352 10/20 0.56
KDM4E B2RXH2 9/20 0.56
RCE1 Q9Y256 1/20 0.56
HPGD P15428 6/20 0.55
HSD17B10 Q99714 6/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
HTT P42858 2/20 0.55
MEN1 O00255 2/20 0.55
TSHR P16473 3/20 0.54
PKM P14618 1/20 0.50
EP300 Q09472 1/20 0.47
KAT2B Q92831 1/20 0.47
KAT8 Q9H7Z6 1/20 0.47
ATM Q13315 1/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
KEAP1 Q14145 1/20 0.46

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
SCHEMBL9657509 0.86 KMT2A (0.54) KMT2AALDH1A1KDM4ERCE1HPGD
SCHEMBL9624082 0.85 KMT2A (0.59) KMT2AALDH1A1KDM4ERCE1HPGD
SCHEMBL7869937 0.82 KMT2A (0.65) KMT2AALDH1A1KDM4ERCE1HPGD
SCHEMBL8889074 0.82 KMT2A (0.80) KMT2AALDH1A1KDM4ERCE1HPGD
SCHEMBL9796404 0.80 KDM4E (0.56) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9624375 0.80 KMT2A (0.67) KMT2AALDH1A1KDM4ERCE1HPGD
SCHEMBL220059 0.80 KMT2A (0.72) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL1638701 0.79 ALDH1A1 (0.62) KMT2AALDH1A1KDM4ERCE1HPGD
SCHEMBL8006673 0.79 KMT2A (0.65) KMT2AALDH1A1KDM4ERCE1HPGD
SCHEMBL1127360 0.79 KMT2A (0.65) KMT2AALDH1A1KDM4ERCE1HPGD

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
WO-1998037078-A1 SOLID PHASE AND COMBINATORIAL SYNTHESIS OF SUBSTITUTED THIOPHENES AND OF ARRAYS OF SUBSTITUTED THIOPHENES NOVO NORDISK A/S (DK) 1998-08-27 WO disclosed