SCHEMBL9631971

SCHEMBL9631971

CCOc1ccc(F)cc1OCCO

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.54
KDM4E B2RXH2 2/20 0.54
GAA P10253 1/20 0.54
L3MBTL1 Q9Y468 6/20 0.51
TDP1 Q9NUW8 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C19 P33261 1/20 0.51
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.43
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
POLB P06746 2/20 0.42
CASP6 P55212 1/20 0.42
MAPT P10636 3/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RAB9A P51151 1/20 0.42
ATM Q13315 1/20 0.42
HPGD P15428 1/20 0.42
KCNH2 Q12809 2/20 0.42

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
SCHEMBL2226476 0.91 HTR2C (0.44) KMT2AKDM4EGAAL3MBTL1TDP1
SCHEMBL18688117 0.90 HTR2C (0.46) KMT2AKDM4EGAAL3MBTL1TDP1
SCHEMBL9632944 0.90 HTR2C (0.46) KMT2AKDM4EGAAL3MBTL1TDP1
SCHEMBL9632842 0.88 FAAH (0.43) KMT2AKDM4EGAAL3MBTL1TDP1
SCHEMBL2523519 0.87 L3MBTL1 (0.53) KMT2AKDM4EGAAL3MBTL1TDP1
SCHEMBL18688122 0.86 L3MBTL1 (0.54) KMT2AKDM4EGAAL3MBTL1TDP1
SCHEMBL4311769 0.84 HTR2C (0.55) KMT2AGAAL3MBTL1TDP1MEN1
SCHEMBL9631985 0.84 KCNH2 (0.54) KMT2AGAAL3MBTL1TDP1MEN1
SCHEMBL28820219 0.83 KMT2A (0.49) KMT2AKDM4EGAAL3MBTL1TDP1
SCHEMBL9632496 0.83 L3MBTL1 (0.51) KMT2AKDM4EL3MBTL1TDP1CYP1A2

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