SCHEMBL7308405

SCHEMBL7308405

CCOC(=O)CCCOc1ccc(Cl)c([N+](=O)[O-])c1C=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.40
MEN1 O00255 4/20 0.40
MAPT P10636 9/20 0.39
GAA P10253 2/20 0.39
HPGD P15428 6/20 0.39
ALDH1A1 P00352 6/20 0.39
LMNA P02545 4/20 0.39
NPSR1 Q6W5P4 4/20 0.39
MAPK1 P28482 3/20 0.39
TLR9 Q9NR96 2/20 0.39
MITF O75030 1/20 0.39
HSP90AA1 P07900 1/20 0.39
PKM P14618 1/20 0.39
KDM4E B2RXH2 2/20 0.38
SMN1; SMN2 Q16637 5/20 0.38
RAB9A P51151 3/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
NPC1 O15118 2/20 0.38
S1PR4 O95977 1/20 0.38
ITGA4 P13612 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
SCHEMBL7318640 0.97 L3MBTL1 (0.38) KMT2AMEN1MAPTGAAHPGD
SCHEMBL7307366 0.96 L3MBTL1 (0.40) KMT2AMEN1MAPTGAAHPGD
SCHEMBL7318843 0.85 L3MBTL1 (0.39) KMT2AMEN1MAPTHPGDALDH1A1
SCHEMBL7306297 0.85 RAB9A (0.38) KMT2AMEN1MAPTGAAHPGD
SCHEMBL7309608 0.85 RAB9A (0.43) KMT2AMEN1MAPTGAAHPGD
Hydrochloric Acid SCHEMBL7306304 0.84 RAB9A (0.42) KMT2AMEN1MAPTGAAHPGD
SCHEMBL7306270 0.82 MAPT (0.43) KMT2AMEN1MAPTGAAHPGD
SCHEMBL7316795 0.81 RAB9A (0.40) KMT2AMEN1MAPTGAAHPGD
SCHEMBL7311708 0.81 RAB9A (0.37) KMT2AMEN1MAPTGAAHPGD
SCHEMBL7311442 0.81 NPC1 (0.43) KMT2AMAPTGAAHPGDALDH1A1

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 8 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-4690925-A ANTITHROMBOTIC ACTIVITY, CARDIOTONIC AGENTS SYNTEX (U.S.A.) INC. (US) 1987-09-01 US disclosed
US-4670434-A ANTICOAGULANT, INOTROPIC AGENT SYNTEX (U.S.A.) INC. (US) 1987-06-02 US 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
EP-0153152-A2 (2-Oxo-1,2,3,5-tetrahydroimidazo-/2,1-b/quinnazolinyl)-oxyalkylamides, their preparation, compositions containing them and their use in making medicaments SYNTEX (U.S.A.) INC. (US) 1985-08-28 EP 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