SCHEMBL10854804

SCHEMBL10854804

CCCCCN1CCN(CCN)C1=O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 2/20 0.39
▸ CYP1A1 P04798 5/20 0.38
▸ ALOX5 P09917 2/20 0.38
▸ PTGS1 P23219 3/20 0.37
▸ PTGS2 P35354 3/20 0.37
▸ MGLL Q99685 3/20 0.37
▸ FAAH O00519 2/20 0.37
▸ GNAI3 P08754 1/20 0.36
▸ GNAO1 P09471 1/20 0.36
▸ GNAI1 P63096 1/20 0.36
▸ S1PR1 P21453 1/20 0.36
▸ BCHE P06276 1/20 0.36
▸ ACHE P22303 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ THRB P10828 1/20 0.36

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
SCHEMBL10848072 0.98 GBA1 (0.41) GBA1ALOX5PTGS1PTGS2MGLL
SCHEMBL10850120 0.94 MEN1 (0.39) GBA1CYP1A1ALOX5GNAI3GNAO1
SCHEMBL4421172 0.90 GBA1 (0.44) GBA1CYP1A1ALOX5PTGS1PTGS2
SCHEMBL31093212 0.88 GBA1 (0.47) GBA1CYP1A1ALOX5PTGS1PTGS2
SCHEMBL9769271 0.88 GBA1 (0.47) GBA1CYP1A1ALOX5PTGS1PTGS2
SCHEMBL9769185 0.88 GBA1 (0.47) GBA1CYP1A1ALOX5PTGS1PTGS2
SCHEMBL31093244 0.88 GBA1 (0.47) GBA1CYP1A1ALOX5PTGS1PTGS2
SCHEMBL9617015 0.88 GBA1 (0.47) GBA1CYP1A1ALOX5PTGS1PTGS2
SCHEMBL10849278 0.86 L3MBTL1 (0.37) CYP1A1S1PR1BCHEACHEALDH1A1
SCHEMBL8392265 0.84 GBA1 (0.45) GBA1CYP1A1ALOX5PTGS1PTGS2

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
US-4632957-A ADHESION PROMOTER PPG INDUSTRIES, INC. (US) 1986-12-30 — — US disclosed
EP-0180736-A1 Ethylenically unsaturated imidazolidones containing alkylene urea groups or alkylene urethane groups PPG INDUSTRIES, INC. (US) 1986-05-14 — — EP disclosed
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