SCHEMBL8052707

SCHEMBL8052707

CCC=CCC=CCC=CCC=CCC=CCCCC(=O)NCCO

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 7/20 1.00
▸ ALDH1A1 P00352 4/20 0.82
▸ MEN1 O00255 2/20 0.80
▸ BLM P54132 2/20 0.80
▸ KMT2A Q03164 2/20 0.80
▸ TRPV1 Q8NER1 2/20 0.80
▸ CNR2 P34972 2/20 0.80
▸ TRPM8 Q7Z2W7 1/20 0.80
▸ FAAH O00519 1/20 0.80
▸ KCNK3 O14649 1/20 0.80
▸ HPGD P15428 2/20 0.73
▸ MAPT P10636 1/20 0.73
▸ ALOX12 P18054 1/20 0.73
▸ TDP1 Q9NUW8 1/20 0.73

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
SCHEMBL13767988 1.00 CNR1 (1.00) CNR1ALDH1A1MEN1BLMKMT2A
SCHEMBL1228841 1.00 CNR1 (1.00) CNR1ALDH1A1MEN1BLMKMT2A
SCHEMBL30603566 0.94 CNR1 (0.88) CNR1ALDH1A1MEN1BLMKMT2A
SCHEMBL886860 0.94 CNR1 (0.88) CNR1ALDH1A1MEN1BLMKMT2A
SCHEMBL10609779 0.94 CNR1 (0.88) CNR1ALDH1A1MEN1BLMKMT2A
SCHEMBL31030918 0.94 CNR1 (0.88) CNR1ALDH1A1MEN1BLMKMT2A
SCHEMBL10600938 0.92 CNR1 (0.85) CNR1ALDH1A1MEN1BLMKMT2A
SCHEMBL2193040 0.90 CNR1 (1.00) CNR1ALDH1A1MEN1BLMKMT2A
SCHEMBL1228084 0.90 CNR1 (1.00) CNR1ALDH1A1MEN1BLMKMT2A
SCHEMBL22301833 0.89 CNR1 (0.80) CNR1ALDH1A1MEN1BLMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-60197642-A — — None — — JP disclosed
EP-0670826-B1 FATTY ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM YISSUM RES DEV CO (IL) 2000-04-26 — — EP disclosed
EP-0161422-B1 ALKANOLAMINE DERIVATIVES AND PLATELET AGGREGATION INHIBITORS CONTAINING THE SAME AS AN ACTIVE INGREDIENT TERUMO KABUSHIKI KAISHA trading as TERUMO CORPORATION (JP) 1989-03-01 — — EP disclosed
US-4794115-A ETHANOLAMINE DERIVATIVES OF NICOTINIC ACID TERUMO CORPORATION (JP) 1988-12-27 — — US disclosed
EP-0228314-A2 Use of ethanol/amine derivatives in treating or preventing hyperlipemia TERUMO KABUSHIKI KAISHA trading as TERUMO CORPORATION (JP) 1987-07-08 — — EP disclosed
US-4619938-A Fatty acid derivatives of aminoalkyl nicotinic acid esters and platelet aggregation inhibitors TERUMO KABUSHIKI KAISHA (JP) 1986-10-28 — — US disclosed
US-4619938-A Fatty acid derivatives of aminoalkyl nicotinic acid esters and platelet aggregation inhibitors TERUMO KABUSHIKI KAISHA (JP) 1986-10-28 — — US disclosed
EP-0161422-A1 Alkanolamine derivatives and platelet aggregation inhibitors containing the same as an active ingredient TERUMO KABUSHIKI KAISHA trading as TERUMO CORPORATION (JP) 1985-11-21 — — EP disclosed
EP-0161422-A1 Alkanolamine derivatives and platelet aggregation inhibitors containing the same as an active ingredient TERUMO KABUSHIKI KAISHA trading as TERUMO CORPORATION (JP) 1985-11-21 — — EP disclosed
JP-S60197642-A ETHANOLAMINE DERIVATIVE AND INHIBITOR OF BLOOD PLATELET AGGREGATION CONTAINING IT AS ACTIVE INGREDIENT TERUMO CORP 1985-10-07 — — JP disclosed
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