SCHEMBL13612957

SCHEMBL13612957

CCc1ccc(C(=O)NC(CO)C(=O)OC)cc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.69
▸ TAS1R3 Q7RTX0 7/20 0.59
▸ TAS1R1 Q7RTX1 7/20 0.59
▸ ALDH1A1 P00352 2/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ GAA P10253 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ PLK1 P53350 1/20 0.51
▸ LMNA P02545 2/20 0.49
▸ LNPEP Q9UIQ6 1/20 0.48
▸ CTSL P07711 1/20 0.46
▸ CTSS P25774 1/20 0.46
▸ CA2 P00918 2/20 0.44
▸ CA1 P00915 1/20 0.44

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
SCHEMBL18803709 0.86 TAS1R3 (0.59) L3MBTL1TAS1R3TAS1R1ALDH1A1TDP1
SCHEMBL12983772 0.84 CA2 (0.61) L3MBTL1TAS1R3TAS1R1ALDH1A1PLK1
SCHEMBL12983773 0.84 CA2 (0.61) L3MBTL1TAS1R3TAS1R1ALDH1A1PLK1
SCHEMBL12983607 0.84 TAS1R3 (0.52) L3MBTL1TAS1R3TAS1R1ALDH1A1GAA
SCHEMBL12983609 0.84 TAS1R3 (0.52) L3MBTL1TAS1R3TAS1R1ALDH1A1GAA
SCHEMBL13885653 0.84 LNPEP (0.56) L3MBTL1TAS1R3TAS1R1GAARAB9A
SCHEMBL5995873 0.83 ALDH1A1 (0.51) L3MBTL1TAS1R3TAS1R1ALDH1A1GAA
SCHEMBL21663897 0.83 TAS1R3 (0.50) L3MBTL1TAS1R3TAS1R1ALDH1A1GAA
SCHEMBL29019437 0.83 TAS1R3 (0.50) L3MBTL1TAS1R3TAS1R1ALDH1A1GAA
SCHEMBL29241144 0.83 TAS1R3 (0.50) L3MBTL1TAS1R3TAS1R1GAARAB9A

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-7638523-B2 Diarylamine-containing compounds and compositions, and their use as modulators of c-kit receptors IRM LLC (BM) 2009-12-29 — — US disclosed
US-20090264649-A1 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS IRM LLC (BM) 2009-10-22 — — US disclosed
US-7592349-B2 Diarylamine-containing compounds and compositions, and their use as modulators of c-kit receptors IRM LLC (BM) 2009-09-22 — — US disclosed
US-7563894-B2 Diarylamine-containing compounds and compositions, and their use as modulators of c-kit receptors IRM LLC (BM) 2009-07-21 — — US disclosed
US-20090012094-A1 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS IRM LLC, A DELAWARE LIMITED LIABILITY COMAPNY (BM) 2009-01-08 — — US disclosed
US-20080167308-A1 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS IRM LLC, A DELAWARE LIMITED LIABILITY COMAPNY (BM) 2008-07-10 — — US disclosed
US-20080139559-A1 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS IRM LLC, A DELAWARE LIMITED LIABILITY COMAPNY (BM) 2008-06-12 — — US disclosed
US-20080139597-A1 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS IRM LLC, A DELAWARE LIMITED LIABILITY COMAPNY (BM) 2008-06-12 — — US disclosed
US-20070149538-A1 Diarylamine-Containing Compounds and Compositions, and their use as Modulators of C-Kit Receptors IRM LLC (BM) 2007-06-28 — — 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 (6 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-20090012094-A1 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS KIT, PRKCH, PRKCE L3MBTL1 4630/4885TAS1R3 2202/4885TAS1R1 2142/4885
US-20090264649-A1 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS KIT, PRKCH, PRKCE L3MBTL1 4630/4885TAS1R3 2202/4885TAS1R1 2142/4885
US-20080139597-A1 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS KIT, PRKCH, PRKCE L3MBTL1 4630/4885TAS1R3 2202/4885TAS1R1 2142/4885
US-20070149538-A1 Diarylamine-Containing Compounds and Compositions, and their use as Modulators of C-Kit Receptors KIT, PRKCH, PRKCE L3MBTL1 4630/4885TAS1R3 2202/4885TAS1R1 2142/4885
US-20080167308-A1 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS KIT, PRKCH, PRKCE L3MBTL1 4630/4885TAS1R3 2202/4885TAS1R1 2142/4885
US-20080139559-A1 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS KIT, PRKCH, PRKCE L3MBTL1 4630/4885TAS1R3 2202/4885TAS1R1 2142/4885

“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.

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