SCHEMBL3296196

SCHEMBL3296196

O=C(O)c1ccc(Oc2ccccc2[N+](=O)[O-])cc1OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSV O60911 5/20 0.54
CTSL P07711 5/20 0.54
POLB P06746 2/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
ATM Q13315 1/20 0.48
HPSE Q9Y251 1/20 0.47
MAPT P10636 2/20 0.47
MCL1 Q07820 1/20 0.46
ESR2 Q92731 1/20 0.45
ALDH1A1 P00352 1/20 0.45
KCNH2 Q12809 1/20 0.45

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
SCHEMBL3298565 0.88 CTSV (0.54) CTSVCTSLPOLBMEN1KMT2A
SCHEMBL3296918 0.84 HPSE (0.52) POLBSENP8SENP7SENP6TDP1
SCHEMBL7552860 0.82 MEN1 (0.53) CTSVCTSLPOLBMEN1KMT2A
SCHEMBL7761815 0.81 MCL1 (0.55) CTSVCTSLPOLBSENP8SENP7
SCHEMBL7907924 0.81 CTSV (0.58) CTSVCTSLTDP1MEN1KMT2A
SCHEMBL646471 0.80 MEN1 (0.54) CTSVCTSLPOLBTDP1MEN1
SCHEMBL30061165 0.80 MEN1 (0.54) CTSVCTSLPOLBTDP1MEN1
SCHEMBL27581338 0.80 MEN1 (0.51) CTSVCTSLPOLBMEN1KMT2A
SCHEMBL1647948 0.80 CYP19A1 (0.64) CTSVCTSLMEN1KMT2AMAPT
SCHEMBL6665583 0.80 MAOB (0.55) CTSVCTSLMEN1KMT2ANPC1

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
EP-1603858-A2 KCNQ CHANNEL MODULATING COMPOUNDS AND THEIR PHARMACEUTICAL USE NeuroSearch A/S (DK) 2005-12-14 EP claimed
WO-2004080377-A2 KCNQ CHANNEL MODULATING COMPOUNDS AND THEIR PHARMACEUTICAL USE NEUROSEARCH A/S (DK) 2004-09-23 WO 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

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 CTSV 4395/4885CTSL 4368/4885POLB 4750/4885

“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.