SCHEMBL9568882

SCHEMBL9568882

CCCCCC1CCN(CCCCC)C1=O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.43
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 3/20 0.37
BCHE P06276 3/20 0.36
ACE P12821 2/20 0.36
GNAI3 P08754 1/20 0.35
GNAO1 P09471 1/20 0.35
GNAI1 P63096 1/20 0.35
ALOX5 P09917 2/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNA7 P36544 1/20 0.35
CHRNA4 P43681 1/20 0.35

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
SCHEMBL6130819 0.98 GBA1 (0.45) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL3270939 0.98 GBA1 (0.45) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL9474303 0.98 GBA1 (0.45) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL6535779 0.98 GBA1 (0.45) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL8602272 0.98 GBA1 (0.45) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL11775340 0.98 GBA1 (0.45) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL28942756 0.97 GBA1 (0.44) GBA1ALDH1A1CYP1A2BCHEGNAI3
SCHEMBL474124 0.95 GBA1 (0.42) GBA1ALDH1A1CYP1A2BCHEACE
SCHEMBL3957901 0.92 CYP1A2 (0.39) GBA1ALDH1A1CYP1A2BCHEACE
SCHEMBL28355004 0.89 CHRNB2 (0.41) GBA1ALDH1A1CYP1A2BCHEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0530095-A1 Improved sensitization of photopolymerizable compositions MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-03-03 EP disclosed