SCHEMBL10375693

SCHEMBL10375693

O=Cc1cccc(OCC(=O)N(CCO)C2CCCCC2)c1[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.39
POLB P06746 1/20 0.39
CASP6 P55212 1/20 0.39
ALDH1A1 P00352 3/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
TSHR P16473 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.35
ALOX15 P16050 1/20 0.34
MC4R P32245 1/20 0.34
MC5R P33032 1/20 0.34
MC3R P41968 1/20 0.34
KMT2A Q03164 1/20 0.34
NPC1 O15118 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL10376685 0.89 PDE3B (0.41) SMN1; SMN2CASP6ALDH1A1MAPTTSHR
SCHEMBL10376981 0.89 PDE3B (0.39) CASP6ALDH1A1MAPTKMT2A
SCHEMBL10376004 0.88 PDE3B (0.38) CASP6ALDH1A1MAPTKMT2A
SCHEMBL7320468 0.88 PDE3B (0.38) CASP6ALDH1A1MAPTKMT2A
SCHEMBL10756723 0.85 PDE3B (0.40) SMN1; SMN2POLBCASP6ALDH1A1LMNA
SCHEMBL10377074 0.85 NPC1 (0.48) SMN1; SMN2POLBALDH1A1LMNAMAPT
SCHEMBL10375692 0.81 PLA2G1B (0.38) SMN1; SMN2POLBCASP6ALDH1A1LMNA
SCHEMBL10374640 0.80 LMNA (0.40) SMN1; SMN2POLBCASP6ALDH1A1LMNA
SCHEMBL10376699 0.78 PTGDR2 (0.42) SMN1; SMN2ALDH1A1LMNAMAPTNPSR1
SCHEMBL10376570 0.78 ALDH1A1 (0.39) SMN1; SMN2CASP6ALDH1A1MAPTTSHR

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