SCHEMBL3302267

SCHEMBL3302267

CC(=O)N(C(C)=O)c1cc(-c2ccccc2)ccc1Oc1ccc(C(=O)O)c(O)c1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 3/20 0.52
HNF4A P41235 2/20 0.52
XDH P47989 7/20 0.43
SLC22A12 Q96S37 4/20 0.43
MCL1 Q07820 2/20 0.43
DHFR P00374 1/20 0.43
ACLY P53396 1/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40
MAOB P27338 1/20 0.39
TSPO P30536 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
SCHEMBL3297956 0.88 ACMSD (0.55) ACMSDHNF4AXDHSLC22A12MCL1
SCHEMBL3297758 0.79 ACMSD (0.59) ACMSDHNF4AXDHSLC22A12MCL1
SCHEMBL10420454 0.78 ACMSD (0.69) ACMSDHNF4AXDHSLC22A12MCL1
SCHEMBL3297396 0.75 HNF4A (0.54) ACMSDHNF4AXDHSLC22A12MCL1
SCHEMBL3302432 0.74 HNF4A (0.39) ACMSDHNF4AXDHSLC22A12MCL1
SCHEMBL24407678 0.72 FFAR1 (0.48) ACMSDHNF4AXDHSLC22A12MCL1
SCHEMBL29810721 0.72 ACMSD (1.00) ACMSDHNF4AXDHSLC22A12MCL1
SCHEMBL2536183 0.72 ACMSD (1.00) ACMSDHNF4AXDHSLC22A12MCL1
SCHEMBL3294710 0.71 HNF4A (0.45) ACMSDHNF4AKDM4E
SCHEMBL14213143 0.70 ALDH1A1 (0.65) ACMSDHNF4AXDHSLC22A12MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060173058-A1 Kcnq channel modulating compounds and their pharmaceutical use NEUROSEARCH A/S (DK) 2006-08-03 US claimed
US-7741352-B2 KCNQ channel modulating compounds and their pharmaceutical use NEUROSEARCH A/S (DK) 2010-06-22 US disclosed
US-7741352-B2 KCNQ channel modulating compounds and their pharmaceutical use NEUROSEARCH A/S (DK) 2010-06-22 US disclosed
US-7741352-B2 KCNQ channel modulating compounds and their pharmaceutical use NEUROSEARCH A/S (DK) 2010-06-22 US disclosed
US-20060173058-A1 Kcnq channel modulating compounds and their pharmaceutical use NEUROSEARCH A/S (DK) 2006-08-03 US disclosed
EP-1603858-A2 KCNQ CHANNEL MODULATING COMPOUNDS AND THEIR PHARMACEUTICAL USE NeuroSearch A/S (DK) 2005-12-14 EP disclosed
WO-2004080377-A2 KCNQ CHANNEL MODULATING COMPOUNDS AND THEIR PHARMACEUTICAL USE NEUROSEARCH A/S (DK) 2004-09-23 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-20060173058-A1 Kcnq channel modulating compounds and their pharmaceutical use KCNQ1, KCNQ2, KCNQ5 ACMSD 3931/4885HNF4A 949/4885XDH 4464/4885

“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.