SCHEMBL8965622

SCHEMBL8965622

CCN(CCCC(=O)O)Cc1cccc(C(=O)O)c1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEP1B Q16820 12/20 0.56
MEP1A Q16819 3/20 0.52
BCHE P06276 2/20 0.49
PPARG P37231 1/20 0.49
ACHE P22303 1/20 0.49
APP P05067 3/20 0.48
LTA4H P09960 1/20 0.47
FOLH1 Q04609 1/20 0.45

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
SCHEMBL4407864 0.87 MEP1B (0.65) MEP1BMEP1ABCHELTA4HFOLH1
SCHEMBL10468744 0.84 BCHE (0.65) BCHEACHEAPP
SCHEMBL1456846 0.80 MEP1B (0.60) MEP1BMEP1ABCHEFOLH1
SCHEMBL14376730 0.80 BCHE (0.72) BCHEACHEAPP
SCHEMBL14376142 0.79 BCHE (0.74) BCHEACHEAPP
SCHEMBL14376731 0.79 BCHE (0.74) BCHEACHEAPP
SCHEMBL14376859 0.79 BCHE (0.74) BCHEACHEAPP
SCHEMBL40108 0.78 MEP1B (0.51) MEP1BMEP1ABCHEACHELTA4H
SCHEMBL5321633 0.77 L3MBTL1 (0.62) BCHEACHEAPP
SCHEMBL4405810 0.76 MEP1B (0.72) MEP1BMEP1AFOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0697015-A1 OPTICALLY ACTIVE 3-(1-(ALKYLAMINO))ALKYL PYRROLIDINES PHARMACIA & UPJOHN COMPANY (US) 1996-02-21 EP claimed
WO-1994026708-A1 OPTICALLY ACTIVE 3-(1-(ALKYLAMINO))ALKYL PYRROLIDINES THE UPJOHN COMPANY (US) 1994-11-24 WO claimed