SCHEMBL7298808

SCHEMBL7298808

CCCC/C=C/C/C=C/[O]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.56
FABP3 P05413 3/20 0.52
PPARG P37231 5/20 0.50
ALDH1A1 P00352 5/20 0.50
PPARD Q03181 4/20 0.50
PPARA Q07869 4/20 0.50
F7 P08709 4/20 0.50
F3 P13726 4/20 0.50
FFAR1 O14842 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
KDM4E B2RXH2 2/20 0.50
LMNA P02545 2/20 0.50
CYP3A4 P08684 2/20 0.50
CYP19A1 P11511 2/20 0.50
FABP4 P15090 2/20 0.50
HPGD P15428 2/20 0.50
ALOX15 P16050 2/20 0.50
NR4A2 P43354 2/20 0.50
HSD17B10 Q99714 2/20 0.50
TDP1 Q9NUW8 2/20 0.50

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
SCHEMBL7298814 1.00 TRPV1 (0.56) TRPV1FABP3PPARGALDH1A1PPARD
SCHEMBL7295440 0.93 TRPV1 (0.65) TRPV1FABP3PPARGALDH1A1PPARD
SCHEMBL7295436 0.93 TRPV1 (0.65) TRPV1FABP3PPARGALDH1A1PPARD
SCHEMBL7290777 0.91 FABP3 (0.63) TRPV1FABP3PPARGALDH1A1PPARD
SCHEMBL7290771 0.91 FABP3 (0.63) TRPV1FABP3PPARGALDH1A1PPARD
SCHEMBL7348367 0.84 TRPV1 (0.48) TRPV1FABP3F7F3LMNA
SCHEMBL7287333 0.84 TRPV1 (0.48) TRPV1FABP3F7F3LMNA
SCHEMBL7286614 0.84 FAAH (0.48) TRPV1FABP3F7F3LMNA
SCHEMBL7286873 0.84
SCHEMBL7286869 0.84

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