SCHEMBL11061527

SCHEMBL11061527

O=C(CCN1CCCC1=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
TSHR P16473 2/20 0.49
NOTUM Q6P988 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
HTT P42858 1/20 0.47
ALDH1A1 P00352 4/20 0.46
MAPK1 P28482 1/20 0.46
POLB P06746 2/20 0.46
LMNA P02545 2/20 0.45
MEN1 O00255 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
ACHE P22303 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
SCHEMBL17948794 0.86 LMNA (0.56) TSHRNOTUML3MBTL1HTTALDH1A1
SCHEMBL25448081 0.84 SMN1; SMN2 (0.53) KMT2ATSHRHTTALDH1A1LMNA
SCHEMBL12027639 0.82 L3MBTL1 (0.56) NPC1RAB9ATSHRNOTUML3MBTL1
SCHEMBL17948720 0.81 L3MBTL1 (0.58) NOTUML3MBTL1HTTALDH1A1MAPK1
SCHEMBL8384325 0.81 GAA (0.44) KMT2ANPC1RAB9ANOTUML3MBTL1
SCHEMBL7974160 0.80 ALDH1A1 (0.45) KMT2ATSHRHTTALDH1A1POLB
SCHEMBL11513567 0.79 HTT (0.57) KMT2ATSHRL3MBTL1HTTLMNA
SCHEMBL7286780 0.79 L3MBTL1 (0.56) KMT2ARAB9ATSHRL3MBTL1HTT
SCHEMBL11128528 0.79 EGFR (0.58) KMT2ANPC1RAB9ANOTUML3MBTL1
SCHEMBL7101708 0.78 NOTUM (0.44) KMT2ANPC1RAB9ANOTUML3MBTL1

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
EP-0110575-A1 1-Aroyl-5-oxo-2-pyrrolidinepropanoic acids and related esters WARNER-LAMBERT COMPANY (US) 1984-06-13 EP disclosed
US-4452990-A TREATMENT OF SENILITY, AMNESIA AND MOTIVATION WARNER-LAMBERT COMPANY (US) 1984-06-05 US disclosed
US-4447435-A HYPOTENSIVE AGENTS THE BOOTS COMPANY PLC (GB) 1984-05-08 US disclosed
US-4442109-A 3-Methylthiomethyl-and 3-methylsulfinylmethyl-4-quinolinones useful for treating hypertension THE BOOTS COMPANY LIMITED (GB) 1984-04-10 US disclosed