SCHEMBL9527554

SCHEMBL9527554

Cc1ccc(C(=NOCCc2ccccc2)c2cccnc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
TBXAS1 P24557 11/20 0.58
KMT2A Q03164 3/20 0.50
MEN1 O00255 1/20 0.50
MAPT P10636 1/20 0.50
TBXA2R P21731 11/20 0.48
TAAR1 Q96RJ0 1/20 0.47
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL9528664 0.96 TBXAS1 (0.60) ALDH1A1TBXAS1KMT2AMEN1MAPT
SCHEMBL9528581 0.92 TBXAS1 (0.59) ALDH1A1TBXAS1KMT2AMEN1MAPT
SCHEMBL9532300 0.91 TBXAS1 (0.57) ALDH1A1TBXAS1KMT2AMEN1TBXA2R
SCHEMBL9528365 0.89 TBXAS1 (0.58) ALDH1A1TBXAS1KMT2AMEN1MAPT
SCHEMBL9529178 0.88 ALDH1A1 (0.60) ALDH1A1TBXAS1KMT2AMEN1MAPT
SCHEMBL9529953 0.88 ALDH1A1 (0.60) ALDH1A1TBXAS1KMT2AMEN1MAPT
SCHEMBL9529664 0.85 TBXAS1 (0.63) ALDH1A1TBXAS1KMT2ATBXA2RKDM4E
SCHEMBL9527676 0.85 TBXAS1 (0.63) ALDH1A1TBXAS1KMT2ATBXA2RKDM4E
SCHEMBL9531922 0.84 TBXAS1 (0.52) ALDH1A1TBXAS1KMT2AMEN1MAPT
SCHEMBL9532138 0.84 TBXAS1 (0.55) ALDH1A1TBXAS1KMT2AMEN1MAPT

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 2 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