SCHEMBL6504745

SCHEMBL6504745

CCO[C@H](C(=O)O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 9/20 0.49
PPARG P37231 6/20 0.47
CYP2D6 P10635 2/20 0.45
SRC P12931 1/20 0.45
MMP8 P22894 1/20 0.45
ALDH1A1 P00352 1/20 0.44
CYP3A4 P08684 1/20 0.44
POLB P06746 1/20 0.44
LMNA P02545 3/20 0.44
CYP1A2 P05177 1/20 0.44
MAPK1 P28482 1/20 0.43

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
SCHEMBL2553482 1.00 PPARA (0.49) PPARAPPARGCYP2D6SRCMMP8
SCHEMBL17653645 1.00 PPARA (0.49) PPARAPPARGCYP2D6SRCMMP8
SCHEMBL27688938 0.89 PTGS2 (0.53) PPARAPPARGALDH1A1CYP1A2
SCHEMBL13491149 0.86 ALDH1A1 (0.47) PPARAPPARGMMP8ALDH1A1CYP3A4
SCHEMBL6972548 0.86 MMP8 (0.44) PPARAPPARGMMP8ALDH1A1CYP3A4
SCHEMBL24327752 0.85 FFAR1 (0.47) PPARAPPARGALDH1A1POLBLMNA
SCHEMBL10355170 0.85 ESR1 (0.44) PPARACYP2D6SRCALDH1A1CYP3A4
SCHEMBL16672673 0.85 MMP8 (0.54) MMP8ALDH1A1LMNA
SCHEMBL5322346 0.85 ALDH1A1 (0.46) PPARAPPARGMMP8ALDH1A1CYP3A4
SCHEMBL17724542 0.85 PPARA (0.47) PPARAPPARGCYP2D6SRCALDH1A1

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-20230399297-A1 Novel Glutamine Analogs JACOBIO PHARMACEUTICALS CO., LTD (CN) 2023-12-14 US disclosed
WO-2022078416-A1 NOVEL GLUTAMINE ANALOGS JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2022-04-21 WO disclosed
US-6943175-B2 2-NH-heteroarylimidazoles with antibacterial activity REPLIDYNE, INC. (US) 2005-09-13 US disclosed
US-20040147548-A1 2-NH-heteroarylimidazoles with antibacterial activity REPLIDYNE, INC. 2004-07-29 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 (2 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-20040147548-A1 2-NH-heteroarylimidazoles with antibacterial activity NSUN3, TRMT1, NOP2 PPARA 3763/4885PPARG 3524/4885CYP2D6 1298/4885
US-20230399297-A1 Novel Glutamine Analogs GLUL, GATD3, GLS PPARA 1857/4885PPARG 1211/4885CYP2D6 3139/4885

“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.