SCHEMBL7285992

SCHEMBL7285992

CCCN1CCNCC1C(C)C=O

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.40
TAAR1 Q96RJ0 1/20 0.32

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
SCHEMBL27282980 0.82 TDP1 (0.47) TDP1TAAR1
SCHEMBL27626232 0.78 TAAR1 (0.35) TDP1TAAR1
SCHEMBL7285985 0.78 TDP1 (0.40) TDP1TAAR1
SCHEMBL293011 0.72 TDP1 (0.45) TDP1TAAR1
SCHEMBL20036401 0.70 TAAR1 (0.45) TDP1TAAR1
SCHEMBL27687723 0.69 TAAR1 (0.36) TDP1TAAR1
SCHEMBL6700157 0.69 TDP1 (0.40) TDP1TAAR1
SCHEMBL3110597 0.69 TAAR1 (0.43) TDP1TAAR1
SCHEMBL18705797 0.69 TAAR1 (0.37) TDP1TAAR1
SCHEMBL3100349 0.69 TAAR1 (0.37) TDP1TAAR1

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