SCHEMBL9528023

SCHEMBL9528023

Clc1ccccc1C(=NOCCc1ccccc1)c1cccnc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
TP53 P04637 1/20 0.48
HPGD P15428 1/20 0.48
TBXAS1 P24557 8/20 0.47
TAAR1 Q96RJ0 1/20 0.46
TBXA2R P21731 7/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
KDM4E B2RXH2 1/20 0.45
KMT2A Q03164 3/20 0.43
NPSR1 Q6W5P4 1/20 0.42
MEN1 O00255 1/20 0.41
VNN1 O95497 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
GPR52 Q9Y2T5 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
SCHEMBL9532300 0.87 TBXAS1 (0.57) SMN1; SMN2NPC1RAB9ATBXAS1TAAR1
SCHEMBL9528581 0.86 TBXAS1 (0.59) SMN1; SMN2NPC1RAB9ATBXAS1TAAR1
SCHEMBL9531922 0.86 TBXAS1 (0.52) SMN1; SMN2NPC1RAB9ATBXAS1TAAR1
SCHEMBL9529774 0.84 ALDH1A1 (0.50) SMN1; SMN2NPC1RAB9ATBXAS1TAAR1
SCHEMBL9531103 0.82 TBXAS1 (0.50) SMN1; SMN2NPC1RAB9ATBXAS1TAAR1
SCHEMBL9528365 0.82 TBXAS1 (0.58) TBXAS1TAAR1TBXA2RALDH1A1LMNA
SCHEMBL9529711 0.80 KMT2A (0.50) SMN1; SMN2NPC1RAB9ATBXAS1TAAR1
SCHEMBL9527554 0.80 ALDH1A1 (0.61) TBXAS1TAAR1TBXA2RALDH1A1LMNA
SCHEMBL9527676 0.79 TBXAS1 (0.63) TBXAS1TBXA2RALDH1A1LMNAKDM4E
SCHEMBL9529664 0.79 TBXAS1 (0.63) TBXAS1TBXA2RALDH1A1LMNAKDM4E

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