SCHEMBL7366950

SCHEMBL7366950

COc1ccc(CN)cc1OCC(=O)N1CCN(C)CC1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.55
GAA P10253 1/20 0.54
ALDH1A1 P00352 2/20 0.52
ALOX15 P16050 1/20 0.52
HSD17B10 Q99714 1/20 0.52
HTT P42858 2/20 0.51
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
TSHR P16473 1/20 0.50
POLB P06746 1/20 0.50
TP53 P04637 2/20 0.49
MAPK1 P28482 1/20 0.49
CASP1 P29466 1/20 0.49
CASP7 P55210 1/20 0.49
MAPT P10636 1/20 0.49
KDM4E B2RXH2 1/20 0.48

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
SCHEMBL7372119 0.87 HPGD (0.58) SMN1; SMN2GAAALDH1A1HSD17B10HTT
SCHEMBL7369950 0.84 KDM4E (0.55) SMN1; SMN2ALDH1A1ALOX15HSD17B10HTT
SCHEMBL7370205 0.84 CCR1 (0.56) SMN1; SMN2GAAALDH1A1HTTKMT2A
SCHEMBL7370428 0.84 ALDH1A1 (0.62) SMN1; SMN2GAAALDH1A1HSD17B10KMT2A
SCHEMBL8545193 0.83 KDM4E (0.54) SMN1; SMN2ALDH1A1KMT2AMEN1TP53
Hydrochloric Acid SCHEMBL16513642 0.83 KMT2A (0.68) SMN1; SMN2GAAALDH1A1HTTKMT2A
SCHEMBL5063868 0.80 CCR1 (0.56) SMN1; SMN2GAAALDH1A1HTTKMT2A
SCHEMBL7370866 0.79 KDM4E (0.58) SMN1; SMN2ALDH1A1KMT2AMEN1TSHR
SCHEMBL7367419 0.77 KMT2A (0.54) SMN1; SMN2GAAALDH1A1HTTKMT2A
SCHEMBL7373261 0.77 ALDH1A1 (0.49) SMN1; SMN2GAAALDH1A1KMT2AMEN1

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
US-5929074-A VSODILATOR, ANTIALLERGIC AND ANTIPLATELET AGENTS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1999-07-27 US disclosed
EP-0706517-B1 PYRIDAZINONE DERIVATIVES WITH PHARMACEUTICAL ACTIVITY NISSAN CHEMICAL IND LTD (JP) 1998-10-21 EP disclosed
US-5728702-A BRONCHODILATOR AGENTS, ANTIALLERGENS OR ANTIPLATELET DRUGGS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-17 US disclosed
EP-0706517-A1 PYRIDAZINONE DERIVATIVES WITH PHARMACEUTICAL ACTIVITY NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1996-04-17 EP disclosed
WO-1995001343-A1 PYRIDAZINONE DERIVATIVES WITH PHARMACEUTICAL ACTIVITY NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1995-01-12 WO disclosed