SCHEMBL6097520

SCHEMBL6097520

CCCOc1ccc(-c2ccc(Cl)cc2)cc1C=O

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 6/20 0.50
ALDH1A1 P00352 6/20 0.49
MAPT P10636 4/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 2/20 0.49
MEN1 O00255 1/20 0.49
L3MBTL1 Q9Y468 3/20 0.43
HPGD P15428 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
PKM P14618 2/20 0.43
GCGR P47871 1/20 0.42
CSNK2A1 P68400 2/20 0.41
TACR2 P21452 1/20 0.41
SLC6A9 P48067 1/20 0.41
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39

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
SCHEMBL6098103 0.89 ERN1 (0.55) ERN1ALDH1A1MAPTKMT2AKDM4E
SCHEMBL14785176 0.87 KMT2A (0.56) ERN1ALDH1A1MAPTKMT2AKDM4E
SCHEMBL30304115 0.87 KMT2A (0.56) ERN1ALDH1A1MAPTKMT2AKDM4E
SCHEMBL7074063 0.81 PTPN11 (0.55) ERN1ALDH1A1MAPTKMT2AKDM4E
SCHEMBL6098475 0.81 ERN1 (0.50) ERN1ALDH1A1MAPTKMT2AKDM4E
SCHEMBL28772019 0.77 MEN1 (0.54) ERN1ALDH1A1MAPTKMT2AKDM4E
SCHEMBL28953715 0.77 ALDH1A1 (0.55) ERN1ALDH1A1MAPTKMT2AKDM4E
SCHEMBL6097515 0.77 ERN1 (0.51) ERN1ALDH1A1MAPTKMT2AKDM4E
SCHEMBL5103559 0.77 ALDH1A1 (0.60) ALDH1A1MAPTKMT2AKDM4EMEN1
SCHEMBL4601206 0.77 PTPN11 (0.64) SLC6A9

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7067535-B2 5-Phenylbenzylamine compounds, process for their production and intermediates for their synthesis TANABE SEIYAKU CO., LTD. (JP) 2006-06-27 US disclosed
US-20040097548-A1 5-Phenylbenzylamine compounds, process for their production and intermediates for their synthesis TANABE SEIYAKI CO., LTD. (JP) 2004-05-20 US disclosed
CN-1466573-A 5-phenylbenzylamine compounds, process for their production and intermediates for their synthesis 田边制药株式会社 2004-01-07 CN disclosed
EP-1323713-A1 5-PHENYLBENZYLAMINE COMPOUNDS, PROCESS FOR THEIR PRODUCTION AND INTERMEDIATES FOR THEIR SYNTHESIS TANABE SEIYAKU CO., LTD. (JP) 2003-07-02 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040097548-A1 5-Phenylbenzylamine compounds, process for their production and intermediates for their synthesis CYP1B1, MAOB, HTR1B ERN1 1413/4885ALDH1A1 136/4885MAPT 3253/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.