SCHEMBL7288127

SCHEMBL7288127

CCCCCCC=CCC=C[C]=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.57
ALDH1A1 P00352 5/20 0.55
PPARG P37231 5/20 0.55
KDM4E B2RXH2 4/20 0.55
F7 P08709 4/20 0.55
F3 P13726 4/20 0.55
PPARD Q03181 4/20 0.55
PPARA Q07869 4/20 0.55
FFAR1 O14842 3/20 0.55
FABP3 P05413 2/20 0.55
LMNA P02545 2/20 0.55
CYP3A4 P08684 2/20 0.55
CYP19A1 P11511 2/20 0.55
FABP4 P15090 2/20 0.55
HPGD P15428 2/20 0.55
ALOX15 P16050 2/20 0.55
PTGS1 P23219 2/20 0.55
AKR1C3 P42330 2/20 0.55
NR4A2 P43354 2/20 0.55
HSD17B10 Q99714 2/20 0.55

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
SCHEMBL7288123 1.00 TRPV1 (0.57) TRPV1ALDH1A1PPARGKDM4EF7
SCHEMBL7289616 0.98 TRPV1 (0.59) TRPV1ALDH1A1PPARGKDM4EF7
SCHEMBL7352387 0.98 TRPV1 (0.59) TRPV1ALDH1A1PPARGKDM4EF7
SCHEMBL7299397 0.92 TRPV1 (0.50) TRPV1ALDH1A1PPARGKDM4EF7
SCHEMBL7299407 0.92 TRPV1 (0.50) TRPV1ALDH1A1PPARGKDM4EF7
SCHEMBL15517766 0.90 FAAH (0.58) TRPV1PPARGF7F3PPARD
SCHEMBL9748338 0.90 FAAH (0.58) TRPV1PPARGF7F3PPARD
SCHEMBL9696115 0.87 FAAH (0.54) TRPV1PPARGF7F3PPARD
SCHEMBL548514 0.87 FAAH (0.54) TRPV1PPARGF7F3PPARD
SCHEMBL910497 0.87 FAAH (0.54) TRPV1PPARGF7F3PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5652247-A VASOPRESSIN ANTAGONIST OTSUKA PHARMACEUTICAL CO., LTD (JP) 1997-07-29 US disclosed
US-5436254-A Vaopressin antagonists OTSUKA PHARMACEUTICAL COMPANY, LTD. (JP) 1995-07-25 US disclosed
EP-0602209-A1 OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-06-22 EP disclosed
EP-0382185-B1 Carbostyril derivatives OTSUKA PHARMA CO LTD (JP) 1994-06-15 EP disclosed
WO-1994001113-A1 OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1994-01-20 WO disclosed
US-5225402-A Vasopressin antagonist, vasodilation, hypotensive, diuretics and anticoagulants OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-07-06 US disclosed
EP-0382185-A2 Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-08-16 EP disclosed