SCHEMBL7307366

SCHEMBL7307366

CCOC(=O)CCCCCOc1ccc(Cl)c([N+](=O)[O-])c1C=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 7/20 0.39
KMT2A Q03164 4/20 0.39
MAPK1 P28482 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 9/20 0.37
LMNA P02545 4/20 0.37
HPGD P15428 4/20 0.37
NPSR1 Q6W5P4 3/20 0.37
TLR9 Q9NR96 2/20 0.37
MITF O75030 1/20 0.37
HSP90AA1 P07900 1/20 0.37
PKM P14618 1/20 0.37
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 2/20 0.36

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 0.99 L3MBTL1 (0.38) L3MBTL1ALDH1A1KMT2AMAPK1TDP1
SCHEMBL7308405 0.96 KMT2A (0.40) L3MBTL1ALDH1A1KMT2AMAPK1TDP1
SCHEMBL7318843 0.88 L3MBTL1 (0.39) L3MBTL1ALDH1A1KMT2AMAPK1TDP1
SCHEMBL7310516 0.85 RAB9A (0.37) ALDH1A1KMT2ACYP3A4MAPTLMNA
SCHEMBL7320935 0.85 RAB9A (0.39) ALDH1A1KMT2ACYP3A4MAPTLMNA
Hydrochloric Acid SCHEMBL7310519 0.84 RAB9A (0.38) ALDH1A1KMT2ACYP3A4MAPTLMNA
SCHEMBL7316795 0.84 RAB9A (0.40) ALDH1A1KMT2ACYP3A4MAPTLMNA
SCHEMBL7311708 0.84 RAB9A (0.37) ALDH1A1KMT2ACYP3A4MAPTLMNA
SCHEMBL7310775 0.84 L3MBTL1 (0.39) L3MBTL1ALDH1A1KMT2AMAPK1TDP1
Hydrochloric Acid SCHEMBL7311714 0.83 RAB9A (0.39) ALDH1A1KMT2ACYP3A4MAPTLMNA

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