SCHEMBL4116572

SCHEMBL4116572

Cc1c(/C(=N\O)c2ccc(Cl)cc2)cc(C(C)(C)C)c(O)c1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLRA3 O75311 1/20 0.46
GLRB P48167 1/20 0.46
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
GFER P55789 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 2/20 0.35
SERPINE1 P05121 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
NR4A1 P22736 1/20 0.34
DHODH Q02127 4/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
POLB P06746 1/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL4116577 1.00 GLRA3 (0.46) GLRA3GLRBRXRARXRBRXRG
SCHEMBL4115756 0.85 GLRA3 (0.50) GLRA3GLRBSMN1; SMN2KMT2ASERPINE1
SCHEMBL4123639 0.77 GLRA3 (0.57) GLRA3GLRBSMN1; SMN2KMT2ASERPINE1
SCHEMBL4126309 0.76 GLRA3 (0.48) GLRA3GLRBSMN1; SMN2ALOX15TSHR
SCHEMBL4116417 0.76 GLRA3 (0.48) GLRA3GLRBSMN1; SMN2KMT2ATSHR
SCHEMBL4122437 0.75 GLRA3 (0.53) GLRA3GLRBRXRARXRBSMN1; SMN2
SCHEMBL4115252 0.74 GLRA3 (0.46) GLRA3GLRBSMN1; SMN2SERPINE1TSHR
SCHEMBL4116615 0.74 GLRA3 (0.51) GLRA3GLRBRXRARXRBSMN1; SMN2
SCHEMBL2788080 0.73 GLRA3 (0.62) GLRA3GLRBSMN1; SMN2KMT2ANPSR1
SCHEMBL4113584 0.73 GLRA3 (0.54) GLRA3GLRBKMT2AALOX15POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090192190-A1 Benzoic Acid Derivatives that are Modulators or Agonists of GlyR ASTRAZENECA AB (SE) 2009-07-30 US claimed
EP-1890993-A2 BENZOIC ACID DERIVATIVES THAT ARE MODULATORS OR ANTAGONISTS OF GLYR AstraZeneca AB (SE) 2008-02-27 EP claimed
WO-2006121390-A2 BENZOIC ACID DERIVATIVES THAT ARE MODULATORS OR AGONISTS OF GLYR ASTRAZENECA AB (SE) 2006-11-16 WO claimed
US-20090192190-A1 Benzoic Acid Derivatives that are Modulators or Agonists of GlyR ASTRAZENECA AB (SE) 2009-07-30 US disclosed
EP-1890993-A2 BENZOIC ACID DERIVATIVES THAT ARE MODULATORS OR ANTAGONISTS OF GLYR AstraZeneca AB (SE) 2008-02-27 EP disclosed
WO-2006121390-A2 BENZOIC ACID DERIVATIVES THAT ARE MODULATORS OR AGONISTS OF GLYR ASTRAZENECA AB (SE) 2006-11-16 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-20090192190-A1 Benzoic Acid Derivatives that are Modulators or Agonists of GlyR GLRA1, GLRB, GPBAR1 GLRA3 6/4885GLRB 2/4885RXRA 216/4885

“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.