SCHEMBL7294233

SCHEMBL7294233

CCCC/C=C/C/C=C/C(C)[C]=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.44
CNR2 P34972 4/20 0.42
PPARG P37231 3/20 0.41
FFAR1 O14842 2/20 0.41
PPARD Q03181 2/20 0.41
PPARA Q07869 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
HSPD1 P10809 1/20 0.41
CYP19A1 P11511 1/20 0.41
FABP4 P15090 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41

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
SCHEMBL7294239 1.00 TRPV1 (0.44) TRPV1CNR2PPARGFFAR1PPARD
SCHEMBL7298670 0.93 TRPV1 (0.50) TRPV1PPARGFFAR1PPARDPPARA
SCHEMBL7298667 0.93 TRPV1 (0.50) TRPV1PPARGFFAR1PPARDPPARA
SCHEMBL7284948 0.88 TSHR (0.37) TRPV1CNR2PPARGMEN1ALDH1A1
SCHEMBL7284954 0.88 TSHR (0.37) TRPV1CNR2PPARGMEN1ALDH1A1
SCHEMBL14371263 0.75 CNR2 (0.44) TRPV1CNR2PPARGFFAR1PPARD
SCHEMBL7299407 0.72 TRPV1 (0.50) TRPV1PPARGFFAR1PPARDPPARA
SCHEMBL7299397 0.72 TRPV1 (0.50) TRPV1PPARGFFAR1PPARDPPARA
SCHEMBL10795402 0.71 TRPV1 (0.50) TRPV1PPARGFFAR1PPARDPPARA
SCHEMBL2164195 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0602209-A1 OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-06-22 EP disclosed
WO-1994001113-A1 OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1994-01-20 WO disclosed
EP-0382185-A2 Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-08-16 EP disclosed