SCHEMBL9656255

SCHEMBL9656255

CC1CC(=O)NN=C1c1ccc(NCC(C)(C)NCC(O)COc2cc(Cl)ccc2[N+](=O)[O-])cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
GALR3 O60755 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
THRB P10828 1/20 0.43
PDE3B Q13370 12/20 0.42
PDE3A Q14432 12/20 0.42
ALDH1A1 P00352 3/20 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
SLC2A1 P11166 1/20 0.38
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
BLM P54132 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL9655901 0.92 L3MBTL1 (0.56) MAPTGALR3SMN1; SMN2L3MBTL1THRB
SCHEMBL9654303 0.92 MAPT (0.48) MAPTGALR3SMN1; SMN2L3MBTL1THRB
SCHEMBL9654315 0.91 MAPT (0.47) MAPTGALR3SMN1; SMN2L3MBTL1THRB
SCHEMBL9654276 0.90 PDE3B (0.45) MAPTGALR3SMN1; SMN2PDE3BPDE3A
SCHEMBL9657593 0.89 PDE3B (0.45) MAPTGALR3SMN1; SMN2PDE3BPDE3A
SCHEMBL9654426 0.88 MAPT (0.46) MAPTGALR3SMN1; SMN2L3MBTL1THRB
SCHEMBL9656783 0.88 PDE3B (0.44) MAPTGALR3SMN1; SMN2PDE3BPDE3A
SCHEMBL9657525 0.87 MAPT (0.44) MAPTGALR3SMN1; SMN2L3MBTL1THRB
SCHEMBL11705278 0.86 L3MBTL1 (0.57) MAPTGALR3SMN1; SMN2L3MBTL1THRB
Oberadilol SCHEMBL8813275 0.86 KDM4E (0.43) MAPTSMN1; SMN2PDE3BPDE3AALDH1A1

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 1 patent. 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