SCHEMBL9529674

SCHEMBL9529674

c1ccc(C(=NOCc2cccc3ccccc23)c2cccnc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 7/20 0.48
MAPT P10636 2/20 0.47
KDM4E B2RXH2 2/20 0.47
GAA P10253 1/20 0.47
ALDH1A1 P00352 7/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TBXA2R P21731 4/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 1/20 0.45
PKM P14618 1/20 0.45
BLM P54132 1/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
ATM Q13315 1/20 0.40

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
SCHEMBL9530809 0.88 ALDH1A1 (0.53) TBXAS1MAPTKDM4EALDH1A1KMT2A
SCHEMBL9529952 0.88 TBXAS1 (0.52) TBXAS1MAPTKDM4EGAAALDH1A1
SCHEMBL9529284 0.80 ALDH1A1 (0.59) TBXAS1MAPTKDM4EGAAALDH1A1
SCHEMBL8710463 0.80 KMT2A (0.56) TBXAS1MAPTKDM4EALDH1A1MEN1
SCHEMBL10406925 0.75 TBXAS1 (0.51) TBXAS1MAPTALDH1A1MEN1KMT2A
SCHEMBL9527696 0.74 TBXAS1 (0.52) TBXAS1MAPTGAAALDH1A1MEN1
SCHEMBL9530136 0.74 ALDH1A1 (0.62) TBXAS1MAPTGAAALDH1A1MEN1
SCHEMBL9529774 0.74 ALDH1A1 (0.50) TBXAS1KDM4EALDH1A1MEN1KMT2A
SCHEMBL9527240 0.73 TBXAS1 (0.49) TBXAS1MAPTALDH1A1MEN1KMT2A
SCHEMBL9529948 0.72 GAA (0.47) TBXAS1MAPTKDM4EGAAALDH1A1

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-0366006-B1 PYRIDYLKETOXIME ETHER COMPOUND AND PHARMACEUTICAL COMPOSITION CONTAINING IT KAKEN PHARMACEUTICAL CO., LTD. (JP) 1993-09-29 EP disclosed
US-4971985-A ANTIISCHEMIC AGENTS, CARDIOVASCULAR DISORDERS KAKEN PHARMACEUTICAL CO., LTD. (JP) 1990-11-20 US disclosed
EP-0366006-A1 Pyridylketoxime ether compound and pharmaceutical composition containing it KAKEN PHARMACEUTICAL CO., LTD. (JP) 1990-05-02 EP disclosed