SCHEMBL7353591

SCHEMBL7353591

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

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
PPARG P37231 2/20 0.30
GPR132 Q9UNW8 1/20 0.30
TRPV1 Q8NER1 1/20 0.30
TRPM8 Q7Z2W7 1/20 0.30

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
SCHEMBL7353595 1.00 ALDH1A1 (0.33) ALDH1A1MAPTFFAR1FFAR4PPARG
SCHEMBL7288387 0.94
SCHEMBL7288396 0.94
SCHEMBL7291485 0.86
SCHEMBL7291486 0.86
SCHEMBL7298035 0.83 FFAR1 (0.40) FFAR1FFAR4PPARGTRPV1
SCHEMBL7298037 0.83 FFAR1 (0.40) FFAR1FFAR4PPARGTRPV1
SCHEMBL7297714 0.83 ALDH1A1 (0.33) ALDH1A1MAPTFFAR1FFAR4
SCHEMBL7297718 0.83 ALDH1A1 (0.33) ALDH1A1MAPTFFAR1FFAR4
SCHEMBL7293639 0.79 LMNA (0.32)

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 6 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