SCHEMBL9633209

SCHEMBL9633209

CCCOc1ccc(F)cc1OCCN

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.52
HTR2A P28223 3/20 0.52
HTR2B P41595 2/20 0.52
KDM4E B2RXH2 2/20 0.50
MAPT P10636 2/20 0.45
HSD17B10 Q99714 1/20 0.45
CSNK2A1 P68400 2/20 0.45
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.45
ALDH1A1 P00352 1/20 0.45
TP53 P04637 1/20 0.45
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
CASP1 P29466 1/20 0.45
HTT P42858 1/20 0.45
CASP7 P55210 1/20 0.45
KMT2A Q03164 1/20 0.45
ATM Q13315 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.41
ESR1 P03372 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
SCHEMBL9632375 0.92 KDM4E (0.48) HTR2CHTR2AHTR2BKDM4EL3MBTL1
SCHEMBL9632943 0.90 L3MBTL1 (0.53) HTR2CHTR2AHTR2BKDM4EMAPT
SCHEMBL18688122 0.86 L3MBTL1 (0.54) HTR2CHTR2AHTR2BKDM4EMAPT
SCHEMBL7478080 0.84 KDM4E (0.52) HTR2AKDM4EMAPTALDH1A1ATM
SCHEMBL7486685 0.84 TDP1 (0.50) HTR2AKDM4EATML3MBTL1TDP1
SCHEMBL9632944 0.83 HTR2C (0.46) HTR2CHTR2AHTR2BKDM4EMAPT
SCHEMBL9633169 0.83 HTR2C (0.49) HTR2CHTR2AHTR2BKDM4EMAPT
SCHEMBL18688117 0.83 HTR2C (0.46) HTR2CHTR2AHTR2BKDM4EMAPT
SCHEMBL18688617 0.82 PDE4D (0.50) HTR2CHTR2AHTR2BKDM4EMAPT
SCHEMBL6790486 0.82 HTR2C (0.47) HTR2CHTR2AHTR2BKDM4EMAPT

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