SCHEMBL9026679

SCHEMBL9026679

CCCCn1cc(C(=O)O)c(=O)c2ccccc21

nearest known ligand 0.90

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 16/20 0.74
LMNA P02545 1/20 0.64
CNR1 P21554 3/20 0.63

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
SCHEMBL4082279 0.96 CNR2 (0.81) CNR2LMNACNR1
SCHEMBL30417203 0.95 CNR2 (0.79) CNR2LMNACNR1
Water SCHEMBL10469548 0.95 CNR2 (0.79) CNR2LMNACNR1
SCHEMBL9029183 0.92 LMNA (0.68) CNR2LMNACNR1
SCHEMBL7347589 0.90 CNR2 (0.69) CNR2CNR1
SCHEMBL31052987 0.86 CNR2 (0.74) CNR2CNR1
SCHEMBL11903673 0.86 CNR2 (0.74) CNR2CNR1
SCHEMBL1661468 0.85 LMNA (0.71) CNR2LMNA
SCHEMBL30421894 0.85 LMNA (0.71) CNR2LMNA
SCHEMBL18833435 0.84 CNR1 (0.68) CNR2LMNACNR1

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
EP-0494978-B1 HETEROCYCLIC COMPOUNDS WYETH JOHN & BROTHER LTD (GB) 1996-02-28 EP disclosed
US-5362734-A Certain benzo-quinolizine compounds and derivatives thereof AMERICAN HOME PRODUCTS CORPORATION (US) 1994-11-08 US disclosed
US-5225419-A Antagonist 5-hydroxytryptamine for treatment of nausea or vomiting JOHN WYETH & BROTHER, LIMITED (GB) 1993-07-06 US disclosed
EP-0494978-A1 HETEROCYCLIC COMPOUNDS. WYETH JOHN & BROTHER LTD (GB) 1992-07-22 EP disclosed
US-5096901-A PHARMACOLOGICALLY ACTIVE AMIDES AND ESTERS CONTAINING AN AZABICYCLOALKANE MOIETY JOHN WYETH & BROTHER LIMITED (GB) 1992-03-17 US disclosed
WO-1991005783-A1 HETEROCYCLIC COMPOUNDS JOHN WYETH & BROTHER LIMITED (GB) 1991-05-02 WO disclosed