SCHEMBL3964569

SCHEMBL3964569

O=C(Nc1ccc2c(c1)OCO2)Nc1cc(Cl)ccc1C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 14/20 1.00
NPC1 O15118 6/20 0.72
RAB9A P51151 6/20 0.72
SMN1; SMN2 Q16637 5/20 0.72
KMT2A Q03164 4/20 0.72
MAPT P10636 3/20 0.72
MEN1 O00255 3/20 0.65
LMNA P02545 1/20 0.65
MAPK1 P28482 1/20 0.65
POLB P06746 2/20 0.63
GRIK2 Q13002 1/20 0.61
NFKB1 P19838 1/20 0.59
NFKB2 Q00653 1/20 0.59
RELA Q04206 1/20 0.59
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58

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
SCHEMBL4345510 0.85 RAB9A (0.75) GRIK1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL1462337 0.81 GRIK1 (1.00) GRIK1GRIK2
SCHEMBL107421 0.80 RAB9A (1.00) NPC1RAB9ASMN1; SMN2KMT2AMAPT
SCHEMBL4355476 0.79 NPC1 (0.73) GRIK1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL3961840 0.78 GRIK1 (1.00) GRIK1NPC1RAB9AKMT2AMAPT
SCHEMBL3958601 0.78 GRIK1 (1.00) GRIK1GRIK2
SCHEMBL23831439 0.77 GRIK1 (0.80) GRIK1GRIK2
SCHEMBL3957527 0.77 GRIK1 (1.00) GRIK1GRIK2
SCHEMBL3455487 0.77 RAB9A (0.85) GRIK1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL3962344 0.77 GRIK1 (1.00) GRIK1GRIK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060069255-A1 Novel aryl ureido benzoic acid derivatives and their use NEUROSEARCH (DK) 2006-03-30 US claimed
US-7521480-B2 Aryl ureido benzoic acid derivatives and their use NEUROSEARCH (DK) 2009-04-21 US disclosed
US-20060069255-A1 Novel aryl ureido benzoic acid derivatives and their use NEUROSEARCH (DK) 2006-03-30 US disclosed
EP-1565429-A2 ARYL UREIDO DERIVATIVES AND THEIR MEDICAL USE NEUROSEARCH A/S (DK) 2005-08-24 EP disclosed
WO-2004046090-A2 ARYL UREIDO DERIVATIVES AND THEIR MEDICAL USE NEUROSEARCH A/S (DK) 2004-06-03 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-20060069255-A1 Novel aryl ureido benzoic acid derivatives and their use GABRA5, GRIK5, GRM5 GRIK1 24/4885NPC1 2512/4885RAB9A 3763/4885

“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.