SCHEMBL9614548

SCHEMBL9614548

CCCCCCCCCCCCCCCCCCc1cc(CC)cc(CCCCCCCCCCCCCCCCCC)c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.53
ALOX5 P09917 5/20 0.53
CYP3A4 P08684 3/20 0.52
ESR1 P03372 2/20 0.52
ADRA2A P08913 2/20 0.52
ADORA3 P0DMS8 2/20 0.52
TACR2 P21452 2/20 0.52
SLC6A2 P23975 2/20 0.52
SLC6A4 P31645 2/20 0.52
SLC6A3 Q01959 2/20 0.52
TP53 P04637 2/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
SHBG P04278 1/20 0.52
HSPD1 P10809 1/20 0.52
ADRB3 P13945 1/20 0.52
HTR2C P28335 1/20 0.52
HSPE1 P61604 1/20 0.52
HIF1A Q16665 1/20 0.52

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
SCHEMBL28575548 1.00 PTGS2 (0.53) PTGS2ALOX5CYP3A4ESR1ADRA2A
SCHEMBL11673558 1.00 PTGS2 (0.53) PTGS2ALOX5CYP3A4ESR1ADRA2A
SCHEMBL1023098 0.96 PTGS2 (0.50) PTGS2ALOX5CYP3A4ESR1ADRA2A
SCHEMBL6262361 0.94 HSPA5 (0.50) PTGS2ALOX5CYP3A4ESR1ADRA2A
SCHEMBL1021654 0.94 ALOX5 (0.49) PTGS2ALOX5CYP3A4ESR1ADRA2A
SCHEMBL872707 0.92 TYR (0.47) PTGS2ALOX5CYP3A4ESR1ADRA2A
SCHEMBL202874 0.90 PTGS2 (0.64) PTGS2ALOX5CYP3A4ESR1ADRA2A
SCHEMBL11806112 0.90 PTGS2 (0.64) PTGS2ALOX5CYP3A4ESR1ADRA2A
SCHEMBL199535 0.90 PTGS2 (0.64) PTGS2ALOX5CYP3A4ESR1ADRA2A
SCHEMBL201605 0.90 PTGS2 (0.64) PTGS2ALOX5CYP3A4ESR1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3898809-A1 A POLYPROPYLENE COMPOSITION BASF SE (DE) 2021-10-27 EP disclosed
WO-2020126752-A1 A POLYPROPYLENE COMPOSITION BASF SE (DE) 2020-06-25 WO disclosed
EP-0472564-A1 ARYLESTERS OF PHOSPHONOUS ACID, PROCESS FOR PREPARING THEM AND THEIR USE TO STABILIZE PLASTICS, IN PARTICULAR POLYOLEFIN MOULDING MATERIALS. HOECHST AG (DE) 1992-03-04 EP disclosed
US-4695599-A Use of dipiperidine-di-carbamates as stabilizers for synthetic polymers CIBA-GEIGY CORPORATION (US) 1987-09-22 US disclosed
EP-0158598-A2 Piperidine compounds CIBA-GEIGY S.p.A. (IT) 1985-10-16 EP disclosed