SCHEMBL9164780

SCHEMBL9164780

CCCCCCCCCCNC(=O)c1ccc(N)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.73
NAAA Q02083 2/20 0.71
CA2 P00918 1/20 0.68
MLYCD O95822 1/20 0.66
THRA P10827 1/20 0.61
THRB P10828 1/20 0.61
ALDH1A1 P00352 4/20 0.60
LMNA P02545 2/20 0.60
MAPK1 P28482 2/20 0.60
SLC22A2 O15244 1/20 0.60
SLC22A1 O15245 1/20 0.60
TSHR P16473 1/20 0.60
ACHE P22303 1/20 0.60
CYP2C19 P33261 1/20 0.60
MAPT P10636 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
BLM P54132 1/20 0.59
PMP22 Q01453 1/20 0.59

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
SCHEMBL9645769 1.00 L3MBTL1 (0.73) L3MBTL1NAAACA2MLYCDTHRA
SCHEMBL11611741 1.00 L3MBTL1 (0.73) L3MBTL1NAAACA2MLYCDTHRA
SCHEMBL11618437 1.00 L3MBTL1 (0.73) L3MBTL1NAAACA2MLYCDTHRA
SCHEMBL11612802 1.00 L3MBTL1 (0.73) L3MBTL1NAAACA2MLYCDTHRA
SCHEMBL1852359 1.00 L3MBTL1 (0.73) L3MBTL1NAAACA2MLYCDTHRA
SCHEMBL10778684 1.00 L3MBTL1 (0.73) L3MBTL1NAAACA2MLYCDTHRA
SCHEMBL11139136 1.00 L3MBTL1 (0.73) L3MBTL1NAAACA2MLYCDTHRA
SCHEMBL11617865 1.00 L3MBTL1 (0.73) L3MBTL1NAAACA2MLYCDTHRA
SCHEMBL11614197 1.00 L3MBTL1 (0.73) L3MBTL1NAAACA2MLYCDTHRA
SCHEMBL11614082 1.00 L3MBTL1 (0.73) L3MBTL1NAAACA2MLYCDTHRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5446189-A Diester intermediates for diacid enzyme inhibitor HOFFMANN-LA ROCHE INC. (US) 1995-08-29 US disclosed
US-5324747-A Treatment of inflammatory diseases HOFFMANN-LA ROCHE INC. (US) 1994-06-28 US disclosed
EP-0579066-A2 N-substituted anilines F. HOFFMANN-LA ROCHE AG (CH) 1994-01-19 EP disclosed
US-4118503-A ANTIULCER AGENTS PFIZER INC. (US) 1978-10-03 US disclosed
US-4117138-A ANTIULCER PFIZER INC. (US) 1978-09-26 US disclosed
US-4064264-A Pyrrolidonecarboxylic acid derivatives as anti-ulcer agents PFIZER INC. (US) 1977-12-20 US disclosed
US-4044147-A N-(acyl)-p-amino-N'-(monosubstituted)-benzamide anti-ulcer agents PFIZER INC. (US) 1977-08-23 US disclosed