SCHEMBL7648006

SCHEMBL7648006

CC(C)c1ccc(-c2nc(Cl)c(C=O)n2Cc2ccc(-c3ccccc3S(=O)(=O)NC#N)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAS1 P04201 1/20 0.39
TP53 P04637 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
AGTR2 P50052 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
SCHEMBL7614979 0.92 AGTR2 (0.41) MAS1AGTR2
SCHEMBL7616661 0.91 AGTR2 (0.38) AGTR2
SCHEMBL7616183 0.89 HTT (0.42) MAS1TP53GAAMAPTSMN1; SMN2
SCHEMBL7651319 0.87 MAS1 (0.42) MAS1TP53GAAMAPTSMN1; SMN2
SCHEMBL7648058 0.86 TP53 (0.42) MAS1TP53GAAMAPTSMN1; SMN2
SCHEMBL7652325 0.85 MAS1 (0.39) MAS1TP53GAAMAPTSMN1; SMN2
SCHEMBL7617557 0.84 AGTR2 (0.36) AGTR2
SCHEMBL7616129 0.83 PTGES2 (0.33) MAS1
SCHEMBL7611026 0.82 MAS1 (0.52) MAS1AGTR2
SCHEMBL7608287 0.81 GP6 (0.59) AGTR2

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
US-6369236-B1 DRUG FOR MEDICAL DIAGNOSIS ANTIARRHYTHMIC PROPRIETIES AND CONTAIN A CARDIOPROTECTIVE COMPOUND. THEY CAN PREVENTIVELY INHIBIT OR STRONGLY REDUCE PATHOPHYSIOLOGIC PROCESSES UPON OCCURRENCE OF ISCHEMIC INJURIES, ESPECIALLY ISCHEMIC CARDIAC AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-04-09 US disclosed
EP-1097141-A1 IMIDAZOLE DERIVATIVES WITH BIPHENYLSULFONYL SUBSTITUTION, METHOD FOR PREPARING THEM AND THEIR USE AS A DRUG OR DIAGNOSTIC AGENT Aventis Pharma Deutschland GmbH (DE) 2001-05-09 EP disclosed
WO-2000003996-A1 IMIDAZOLE DERIVATIVES WITH BIPHENYLSULFONYL SUBSTITUTION, METHOD FOR PREPARING THEM AND THEIR USE AS A DRUG OR DIAGNOSTIC AGENT AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-01-27 WO disclosed