SCHEMBL10375692

SCHEMBL10375692

CC(O)N(C(=O)COc1cccc(C=O)c1[N+](=O)[O-])C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.37
POLB P06746 1/20 0.37
LMNA P02545 4/20 0.35
NPSR1 Q6W5P4 3/20 0.35
NPC1 O15118 2/20 0.35
HPD P32754 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.34
ALDH1A1 P00352 6/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MAPT P10636 2/20 0.34
S1PR4 O95977 1/20 0.34
ITGA4 P13612 1/20 0.34
HPGD P15428 1/20 0.34
S1PR1 P21453 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34
TLR9 Q9NR96 1/20 0.34
GAA P10253 2/20 0.34

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
SCHEMBL10376684 0.90 PDE3B (0.38) SMN1; SMN2NPSR1ALDH1A1L3MBTL1MAPT
SCHEMBL10376980 0.89 PDE3B (0.36) SMN1; SMN2NPSR1ALDH1A1L3MBTL1MAPT
SCHEMBL10376003 0.88 PDE3B (0.36) SMN1; SMN2ALDH1A1L3MBTL1MAPTHPGD
SCHEMBL7320463 0.88 PDE3B (0.36) SMN1; SMN2ALDH1A1L3MBTL1MAPTHPGD
SCHEMBL10377074 0.86 NPC1 (0.48) SMN1; SMN2POLBLMNANPSR1NPC1
SCHEMBL10375693 0.81 SMN1; SMN2 (0.39) SMN1; SMN2POLBLMNANPSR1NPC1
SCHEMBL10374639 0.81 LMNA (0.42) PLA2G1BATG4BSMN1; SMN2LMNANPSR1
SCHEMBL10756723 0.81 PDE3B (0.40) SMN1; SMN2POLBLMNANPSR1NPC1
SCHEMBL10376698 0.79 PTGDR2 (0.41) PLA2G1BATG4BSMN1; SMN2LMNANPSR1
SCHEMBL7306576 0.77 PDE3B (0.48) ALDH1A1HPGDKDM4EMEN1KMT2A

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