SCHEMBL9632436

SCHEMBL9632436

COc1c(F)cccc1OCCCl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.49
TDP1 Q9NUW8 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.43
KMT2A Q03164 2/20 0.38
CHRM2 P08172 2/20 0.38
LMNA P02545 2/20 0.38
CHRM1 P11229 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
ACHE P22303 1/20 0.38
KCNH2 Q12809 1/20 0.38
HIF1A Q16665 1/20 0.38
MAPT P10636 4/20 0.37
MAPK1 P28482 3/20 0.37
ALDH1A1 P00352 1/20 0.37
FFAR4 Q5NUL3 1/20 0.36
HPGD P15428 1/20 0.36
HTR1A P08908 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35

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
SCHEMBL9633992 0.84 KDM4E (0.52) L3MBTL1TDP1SMN1; SMN2KMT2ACHRM2
SCHEMBL9634005 0.83 L3MBTL1 (0.49) L3MBTL1TDP1SMN1; SMN2KMT2ACHRM2
SCHEMBL2035810 0.80 L3MBTL1 (0.53) L3MBTL1TDP1SMN1; SMN2KMT2AMAPT
SCHEMBL7682704 0.79 SCN8A (0.36) L3MBTL1TDP1SMN1; SMN2HTR1ASLC6A2
SCHEMBL21246942 0.79 L3MBTL1 (0.43) L3MBTL1TDP1SMN1; SMN2KMT2ALMNA
SCHEMBL30750877 0.78 SLC6A2 (0.44) L3MBTL1TDP1KMT2AALDH1A1HTR1A
SCHEMBL17393516 0.78 SLC6A2 (0.44) L3MBTL1TDP1KMT2AALDH1A1HTR1A
SCHEMBL5824853 0.77 L3MBTL1 (0.58) L3MBTL1TDP1SMN1; SMN2KMT2AMAPK1
SCHEMBL29669870 0.77 NFE2L2 (0.50) L3MBTL1TDP1SMN1; SMN2KMT2ALMNA
SCHEMBL1627720 0.77 NFE2L2 (0.50) L3MBTL1TDP1SMN1; SMN2KMT2ALMNA

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-0331943-B1 PHENOXYETHYLAMINE DERIVATIVES, PROCESS FOR PREPARING THE SAME, AND COMPOSITION FOR EXHIBITING EXCELLENT ALPHA-1-BLOCKING ACTIVITY CONTAINING THE SAME Hokuriku Pharmaceutical Co.,Ltd (JP) 1992-06-17 EP disclosed
US-4971990-A HYPOTENSIVE AGENTS, DYSUREA HOKURIKU PHARMACEUTICAL CO., LTD. (JP) 1990-11-20 US disclosed
EP-0331943-A1 Phenoxyethylamine derivatives, process for preparing the same, and composition for exhibiting excellent alpha-1-blocking activity containing the same Hokuriku Pharmaceutical Co.,Ltd (JP) 1989-09-13 EP disclosed