SCHEMBL13349554

SCHEMBL13349554

Cc1ccc2ccc(Oc3ccc(OCCC(=O)O)cc3)nc2c1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.58
FFAR4 Q5NUL3 1/20 0.46
PPARG P37231 2/20 0.45
TSHR P16473 1/20 0.44
CYSLTR2 Q9NS75 1/20 0.42
CYSLTR1 Q9Y271 1/20 0.42
MCL1 Q07820 1/20 0.42
LTA4H P09960 3/20 0.41
DPP4 P27487 1/20 0.40
MMP2 P08253 1/20 0.40
AR P10275 1/20 0.40
FFAR1 O14842 1/20 0.40
MAP4K4 O95819 1/20 0.40

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
SCHEMBL27259397 0.87 FFAR1 (0.47) L3MBTL1MCL1FFAR1
SCHEMBL13349555 0.84 L3MBTL1 (0.43) L3MBTL1FFAR4PPARGTSHRCYSLTR2
SCHEMBL13316456 0.79 KMT2A (0.57) L3MBTL1TSHRMAP4K4
SCHEMBL27259406 0.76 TDP1 (0.48) L3MBTL1PPARG
SCHEMBL13316457 0.76 TDP1 (0.48) L3MBTL1PPARG
SCHEMBL1806524 0.76 L3MBTL1 (1.00) L3MBTL1FFAR4TSHRMCL1MMP2
SCHEMBL27259726 0.72 HTT (0.53) L3MBTL1MCL1FFAR1
SCHEMBL27259375 0.72 PTPN7 (0.43) FFAR4TSHRFFAR1
SCHEMBL27259343 0.72 PTPN7 (0.46) L3MBTL1PPARGCYSLTR2CYSLTR1FFAR1
SCHEMBL27259321 0.72 CTRC (0.47) L3MBTL1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7728007-B2 Therapeutic amides WAYNE STATE UNIVERSITY (US) 2010-06-01 US disclosed
US-7585863-B2 Antitumor agents; such as (2-(4-(7-Chloro-2-quinoxalinyl)oxy)propionylamino ethansulfonic acid; {2-{4-(7-Chloro-quinoxalin-2-yloxy)-phenoxy}propionyl amino}acetic acid WAYNE STATE UNIVERSITY (US) 2009-09-08 US disclosed
US-7507749-B2 Antitumor agents WAYNE STATE UNIVERSITY (US) 2009-03-24 US disclosed
US-20090076073-A1 THERAPEUTIC AMIDES WAYNE STATE UNIVERSITY 2009-03-19 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 (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-20090076073-A1 THERAPEUTIC AMIDES HDAC5, HDAC6, ASAH2 L3MBTL1 2501/4885FFAR4 3038/4885PPARG 435/4885

“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.