SCHEMBL8971303

SCHEMBL8971303

CCCCCC(=O)N[C@@H](Cc1cnc(SCCC)n1Cc1ccccc1Cl)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
FAAH O00519 2/20 0.42
HTT P42858 1/20 0.40
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL8971301 1.00 TP53 (0.44) TP53FAAHHTTALDH1A1
SCHEMBL7056869 0.94 TP53 (0.45) TP53ALDH1A1
SCHEMBL9473359 0.89 TP53 (0.44) TP53FAAH
SCHEMBL8957103 0.89 TP53 (0.44) TP53
SCHEMBL8957111 0.89 TP53 (0.44) TP53
SCHEMBL8957074 0.89 TP53 (0.45) TP53
SCHEMBL8957081 0.89 TP53 (0.45) TP53
SCHEMBL8957094 0.87 TP53 (0.43) TP53
SCHEMBL8957085 0.87 TP53 (0.43) TP53
SCHEMBL9475000 0.85 TP53 (0.46) TP53

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-5565480-A ANGIOTENSIN II RECEPTOR ANTAGONIST; USEFUL IN REGULATING HYPERTENSION, TREATMENT OF CONGESTIVE HEART FAILURE, RENAL FAILURE AND GLUCOMA SMITHKLINE BEECHAM CORPORATION (US) 1996-10-15 US disclosed
US-5444081-A Treatment of hypertension, congestive heart failure, renal failure, glaucoma SMITHKLINE BEECHAM CORP (US) 1995-08-22 US disclosed
WO-1992000068-A1 SUBSTITUTED HISTIDINES SMITHKLINE BEECHAM CORPORATION (US) 1992-01-09 WO disclosed