SCHEMBL4419652

SCHEMBL4419652

CCOCCCCCCOCC(N)N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.44
USP2 O75604 1/20 0.41
SPHK1 Q9NYA1 1/20 0.36
PRKD3 O94806 1/20 0.35
PRKCG P05129 1/20 0.35
PRKCB P05771 1/20 0.35
PRKCA P17252 1/20 0.35
PRKCH P24723 1/20 0.35
PRKCI P41743 1/20 0.35
PRKCE Q02156 1/20 0.35
PRKCQ Q04759 1/20 0.35
PRKCZ Q05513 1/20 0.35
PRKCD Q05655 1/20 0.35
PRKD1 Q15139 1/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP3A4 P08684 1/20 0.34
LPAR1 Q92633 7/20 0.34
LPAR3 Q9UBY5 7/20 0.34
LPAR5 Q9H1C0 4/20 0.34
LPAR2 Q9HBW0 4/20 0.34

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
SCHEMBL4422860 0.98 HTT (0.41) HTTUSP2SPHK1PRKD3PRKCG
SCHEMBL1699179 0.93 HTT (0.36) HTTUSP2ALDH1A1CYP3A4TSHR
SCHEMBL1160884 0.87 ALDH1A1 (0.42) HTTALDH1A1TSHR
Hydrochloric Acid SCHEMBL6464397 0.85 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL1157501 0.85 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL9229997 0.85 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL28965774 0.85 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL3443836 0.84 HTT (0.52) HTTUSP2SPHK1PRKD3PRKCG
SCHEMBL3443839 0.79 HTT (0.35) HTTUSP2ALDH1A1TSHR
SCHEMBL454517 0.79

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-2029713-A1 LIQUID DETERGENT COMPOSITIONS WITH LOW POLYDISPERSITY POLYACRYLIC ACID BASED POLYMERS The Procter and Gamble Company (US) 2009-03-04 EP disclosed
WO-2007149806-A1 LIQUID DETERGENT COMPOSITIONS WITH LOW POLYDISPERSITY POLYACRYLIC ACID BASED POLYMERS THE PROCTER & GAMBLE COMPANY (US) 2007-12-27 WO disclosed