SCHEMBL9655901

SCHEMBL9655901

Cc1ccc([N+](=O)[O-])c(OCC(O)CNC(C)(C)CNc2ccc(C3=NNC(=O)CC3C)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.56
MAPT P10636 4/20 0.48
GALR3 O60755 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
THRB P10828 1/20 0.43
PDE3B Q13370 12/20 0.42
PDE3A Q14432 12/20 0.42
ALDH1A1 P00352 4/20 0.42
LMNA P02545 2/20 0.42
MAPK1 P28482 2/20 0.42
SLFN12 Q8IYM2 1/20 0.42
GAA P10253 1/20 0.42
KDM4E B2RXH2 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
BLM P54132 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TNNC1 P63316 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
SCHEMBL9654303 0.93 MAPT (0.48) L3MBTL1MAPTGALR3SMN1; SMN2THRB
SCHEMBL9654315 0.92 MAPT (0.47) L3MBTL1MAPTGALR3SMN1; SMN2THRB
SCHEMBL9656255 0.92 MAPT (0.47) L3MBTL1MAPTGALR3SMN1; SMN2THRB
SCHEMBL9656799 0.89 PDE3B (0.46) L3MBTL1MAPTGALR3SMN1; SMN2PDE3B
SCHEMBL9657585 0.89 PDE3B (0.45) L3MBTL1MAPTGALR3SMN1; SMN2PDE3B
SCHEMBL9654443 0.88 MAPT (0.46) L3MBTL1MAPTGALR3SMN1; SMN2THRB
SCHEMBL9655934 0.88 PDE3B (0.45) L3MBTL1MAPTGALR3SMN1; SMN2PDE3B
SCHEMBL11705278 0.87 L3MBTL1 (0.57) L3MBTL1MAPTGALR3SMN1; SMN2THRB
SCHEMBL10568606 0.87 MAPT (0.44) L3MBTL1MAPTGALR3SMN1; SMN2THRB
SCHEMBL9654426 0.86 MAPT (0.46) L3MBTL1MAPTGALR3SMN1; SMN2THRB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0259835-B1 PYRIDAZINONE DERIVATIVES TEIKOKU HORMONE MFG. CO., LTD. (JP) 1992-01-15 EP disclosed
US-4843072-A Antihypertensive pyridazinone aminoisopropanol derivatives TEIKOKU HORMONE MFG. CO., LTD. (JP) 1989-06-27 US disclosed
EP-0259835-A2 Pyridazinone derivatives TEIKOKU HORMONE MFG. CO., LTD. (JP) 1988-03-16 EP disclosed