SCHEMBL481104

SCHEMBL481104

CC(=O)c1ccc(NCc2ccc(C(OC3CCCCO3)c3cccc(C#N)c3)cc2)c(C)c1O

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.34
MGLL Q99685 1/20 0.32
KLKB1 P03952 3/20 0.32
ENPP2 Q13822 1/20 0.32
HTT P42858 1/20 0.32
KCNK3 O14649 1/20 0.31
ACACB O00763 1/20 0.31
TACR1 P25103 1/20 0.31
MRGPRX1 Q96LB2 1/20 0.31
EPHX1 P07099 1/20 0.31
HIF1A Q16665 1/20 0.31
CCR2 P41597 1/20 0.31
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
VNN1 O95497 1/20 0.31
EP300 Q09472 1/20 0.31
CREBBP Q92793 1/20 0.31
ROCK2 O75116 1/20 0.30
CTSC P53634 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
SCHEMBL481001 0.92 ACACB (0.35) HTTACACBEPHX1HIF1ACREBBP
SCHEMBL481249 0.90 PTGER4 (0.33) PTGER4MGLLENPP2KCNK3
SCHEMBL481200 0.86 MAPT (0.44)
SCHEMBL480993 0.83 MAPT (0.46) TACR1MRGPRX1
SCHEMBL480979 0.81 LRRK2 (0.38) PTGER4TACR1MRGPRX1CREBBP
SCHEMBL481126 0.81 PTGER1 (0.37) PTGER4ACACB
SCHEMBL481036 0.80 CYSLTR1 (0.35) PTGER4CREBBP
SCHEMBL481233 0.80 PTGER4 (0.35) PTGER4ACACBTACR1MRGPRX1
SCHEMBL13645751 0.80 PTGER4 (0.35) PTGER4EP300CREBBP
SCHEMBL481038 0.80 LRRK2 (0.38) PTGER4HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2441762-A1 Potentiators of Glutamate Receptors Eli Lilly and Company (US) 2012-04-18 EP disclosed
EP-1817301-B1 POTENTIATORS OF GLUTAMATE RECEPTORS LILLY CO ELI (US) 2012-02-01 EP disclosed
US-7816523-B2 Potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2010-10-19 US disclosed
US-7803938-B2 Potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2010-09-28 US disclosed
US-20090318481-A1 Potentiators Of Glutamate Receptors AICHER THOMAS DANIEL 2009-12-24 US disclosed
US-20090318483-A1 Potentiators Of Glutamate Receptors AICHER THOMAS DANIEL 2009-12-24 US disclosed
US-7598423-B2 Potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2009-10-06 US disclosed
US-20080139505-A1 Potentiators Of Glutamate Receptors ARRAY BIOPHARMA, INC. 2008-06-12 US disclosed
EP-1817301-A1 POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2007-08-15 EP disclosed
WO-2006057870-A1 POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2006-06-01 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 (3 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-20080139505-A1 Potentiators Of Glutamate Receptors GRM1, GRIN1, GRM2 PTGER4 572/4885MGLL 2253/4885KLKB1 3623/4885
US-20090318481-A1 Potentiators Of Glutamate Receptors GRIK1, GRIK2, GRIK4 PTGER4 418/4885MGLL 1853/4885KLKB1 1125/4885
US-20090318483-A1 Potentiators Of Glutamate Receptors GRIK1, GRIK2, GRIK4 PTGER4 418/4885MGLL 1853/4885KLKB1 1125/4885

“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.