SCHEMBL7364780

SCHEMBL7364780

CC(C)(C)NS(=O)(=O)c1ccccc1-c1ccc(NC(=O)C(Cl)Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 11/20 0.51
FEN1 P39748 11/20 0.51
FPR2 P25090 2/20 0.48
FPR1 P21462 1/20 0.48
MAPT P10636 3/20 0.47
MEN1 O00255 2/20 0.47
HTT P42858 2/20 0.47
KMT2A Q03164 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
GPR55 Q9Y2T6 2/20 0.46
LMNA P02545 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
PKM P14618 1/20 0.46
CNR1 P21554 1/20 0.46
CYP2C19 P33261 1/20 0.46
MMP3 P08254 1/20 0.44

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
SCHEMBL7061589 0.82 ALDH1A1 (0.54) ALOX5APFEN1FPR2FPR1MAPT
SCHEMBL6749780 0.82 PTPN1 (0.53) ALOX5APFEN1FPR2FPR1MMP3
SCHEMBL6618487 0.82 USP30 (0.43) ALOX5APFEN1USP30
SCHEMBL6807899 0.81 FPR2 (0.50) ALOX5APFEN1FPR2FPR1MEN1
Cyclopentane SCHEMBL7093842 0.81 FPR2 (0.52) ALOX5APFEN1FPR2FPR1ALDH1A1
SCHEMBL6752209 0.80 ALOX5AP (0.48) ALOX5APFEN1FPR2FPR1GPR119
SCHEMBL890655 0.78 ALOX5AP (0.53) ALOX5APFEN1GPR119
SCHEMBL8429813 0.78 ALOX5AP (0.54) ALOX5APFEN1GPR119
SCHEMBL6381183 0.77 USP30 (0.56) FPR2FPR1USP30
SCHEMBL6375140 0.77 USP30 (0.56) FPR2FPR1USP30

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6043257-A ANTICOAGULANT; PYRIDINE SUBSTITUTED INDAZOLE COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-03-28 US disclosed
EP-0960102-A1 AMIDINOINDOLES, AMIDINOAZOLES, AND ANALOGS THEREOF AS INHIBITORS OF FACTOR Xa AND OF THROMBIN Du Pont Pharmaceuticals Company (US) 1999-12-01 EP disclosed
US-5886191-A ANTICOAGULANTS DUPONT PHARMACEUTICALS COMPANY (US) 1999-03-23 US disclosed
WO-1998001428-A1 AMIDINOINDOLES, AMIDINOAZOLES, AND ANALOGS THEREOF AS INHIBITORS OF FACTOR Xa AND OF THROMBIN DU PONT PHARMACEUTICALS COMPANY (US) 1998-01-15 WO disclosed