SCHEMBL10376014

SCHEMBL10376014

CCCCCCN(C(=O)CCCCOc1ccc([N+](=O)[O-])c(C=O)c1)C1CCCC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 14/20 0.41
PDE3A Q14432 14/20 0.41
P2RY12 Q9H244 8/20 0.41
PDE2A O00408 7/20 0.41
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
PLA2G4B P0C869 1/20 0.39
SIRT5 Q9NXA8 1/20 0.39
HPGD P15428 1/20 0.38
PTGES O14684 1/20 0.38
ALOX5 P09917 1/20 0.38

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
SCHEMBL7316875 0.99 PDE3B (0.42) PDE3BPDE3AP2RY12PDE2ATHRA
SCHEMBL10376932 0.96 PDE3B (0.44) PDE3BPDE3AP2RY12PDE2AHPGD
SCHEMBL10377093 0.96 PDE3B (0.43) PDE3BPDE3AP2RY12PDE2AHPGD
SCHEMBL10374909 0.94 PDE3B (0.44) PDE3BPDE3AP2RY12PDE2ASIRT5
SCHEMBL10375775 0.93 PDE3B (0.45) PDE3BPDE3AP2RY12PDE2AHPGD
SCHEMBL10376853 0.92 PDE3B (0.48) PDE3BPDE3AP2RY12PDE2AHPGD
SCHEMBL7312013 0.91 PDE3B (0.41) PDE3BPDE3AP2RY12PDE2AHPGD
SCHEMBL10376785 0.90 PDE3B (0.47) PDE3BPDE3AP2RY12PDE2AHPGD
SCHEMBL10374868 0.90 PDE3B (0.47) PDE3BPDE3AP2RY12PDE2AHPGD
SCHEMBL10376736 0.90 PDE3B (0.45) PDE3BPDE3AP2RY12PDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0116948-B1 (2-OXO-1,2,3,5-TETRAHYDROIMIDAZO-(2,1-B)QUINAZOLINYL)-OXYALKYL-AMIDES SYNTEX (U.S.A.) INC. (US) 1990-01-03 EP disclosed
US-4663320-A ANTITUMOR AGENTS, ANTICOAGULANTS SYNTEX (U.S.A.) INC. (US) 1987-05-05 US disclosed
US-4551459-A Method of treating heart failure using (2-oxo-1,2,3,5-tetrahydroimidazo-[2,1-b]quinazolinyl)oxyalkylamides SYNTEX (U.S.A.) INC. (US) 1985-11-05 US disclosed
US-4490371-A ANTICOAGULANTS, PHOSPHODIESTERASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1984-12-25 US disclosed
EP-0116948-A2 (2-Oxo-1,2,3,5-tetrahydroimidazo-(2,1-b)quinazolinyl)-oxyalkyl-amides SYNTEX (U.S.A.) INC. (US) 1984-08-29 EP disclosed