SCHEMBL3296180

SCHEMBL3296180

COc1cccc(-c2ccc(COc3ccc(C(=O)O)c(O)c3)cc2)c1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.57
FFAR1 O14842 5/20 0.57
GNA15 P30679 1/20 0.57
PTGER4 P35408 1/20 0.56
HCAR2 Q8TDS4 1/20 0.54
MAOB P27338 2/20 0.54
PPARD Q03181 3/20 0.53
PPARA Q07869 2/20 0.53
MRGPRX4 Q96LA9 2/20 0.52
APP P05067 1/20 0.52
DHODH Q02127 1/20 0.51

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
SCHEMBL3297208 0.92 FFAR1 (0.61) MCL1FFAR1PTGER4MAOBPPARD
SCHEMBL3297207 0.88 MCL1 (0.62) MCL1FFAR1HCAR2MAOBMRGPRX4
SCHEMBL22126669 0.88 MCL1 (0.62) MCL1FFAR1PTGER4MAOBMRGPRX4
SCHEMBL3297175 0.87 MCL1 (0.68) MCL1FFAR1PTGER4MAOBMRGPRX4
SCHEMBL3294761 0.85 NR4A2 (0.61) MCL1MAOBMRGPRX4
SCHEMBL3304188 0.85 MAOB (0.60) MCL1MAOBMRGPRX4
SCHEMBL22126657 0.85 HNF4A (0.65) DHODH
SCHEMBL3303483 0.84 MCL1 (0.58) MCL1FFAR1MAOBMRGPRX4APP
SCHEMBL3293601 0.84 PTGER4 (0.56) MCL1PTGER4MAOB
SCHEMBL3296263 0.82 NR4A2 (0.67) MCL1FFAR1MAOBMRGPRX4

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 9 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
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 MCL1 2555/4885FFAR1 2151/4885GNA15 2290/4885

“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.