SCHEMBL5318653

SCHEMBL5318653

C[CH]c1cc(Cl)cc2c1OCCO2

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.36
MEN1 O00255 1/20 0.36
PLA2G1B P04054 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
ATG4B Q9Y4P1 1/20 0.36
KDM4E B2RXH2 2/20 0.33
PLK1 P53350 1/20 0.33
ALDH1A1 P00352 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAP3K14 Q99558 3/20 0.31
HTR1A P08908 1/20 0.30
LARS1 Q9P2J5 1/20 0.30

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
SCHEMBL30933917 0.81 ERN1 (0.44) POLBMEN1PLA2G1BGAAMAPT
SCHEMBL1748466 0.81 ERN1 (0.44) POLBMEN1PLA2G1BGAAMAPT
SCHEMBL21994926 0.76 PARP1 (0.36)
SCHEMBL13534197 0.75 MAP3K14 (0.42) MEN1GAAKMT2AKDM4EPLK1
SCHEMBL6002004 0.72 ERN1 (0.50) POLBMEN1PLA2G1BGAAMAPT
SCHEMBL31276593 0.71 MAP3K14 (0.33) MAP3K14HTR1ALARS1
SCHEMBL263819 0.71 MEN1 (0.41) MEN1MAPTKMT2AMAP3K14HTR1A
SCHEMBL4167422 0.71 MAPT (0.39) GAAMAPTKDM4EALDH1A1TDP1
SCHEMBL3026099 0.71 KDM4E (0.54) KDM4E
SCHEMBL23350956 0.70 MAP3K14 (0.31) MAP3K14HTR1ALARS1

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-1856075-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND THEIR USE AS 5-HT6 MODULATORS Epix Delaware, Inc. (US) 2007-11-21 EP disclosed
US-20060205737-A1 Substituted arylamine compounds and methods of treatment GALENEA CORPORATION 2006-09-14 US disclosed
WO-2006081332-A1 SUBSTITUTED ARYLAMINE COMPOUNDS AND THEIR USE AS 5-HT6 MODULATORS EPIX DELAWARE, INC. (US) 2006-08-03 WO 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-20060205737-A1 Substituted arylamine compounds and methods of treatment HTR6, HTR2A, HTR3B POLB 4143/4885MEN1 3832/4885PLA2G1B 2335/4885

“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.