SCHEMBL6580327

SCHEMBL6580327

COc1ccc(OCCC(=O)O)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.55
PPARG P37231 4/20 0.54
LMNA P02545 1/20 0.54
TDP1 Q9NUW8 1/20 0.52
PPARA Q07869 4/20 0.50
MAPT P10636 3/20 0.50
S1PR4 O95977 1/20 0.50
RAB9A P51151 1/20 0.49
HSD17B10 Q99714 1/20 0.49
MCL1 Q07820 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
MAPK1 P28482 1/20 0.47
CYSLTR2 Q9NS75 1/20 0.47
CYSLTR1 Q9Y271 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL2988803 0.84 LMNA (0.66) LMNAPPARAMAPTHSD17B10L3MBTL1
SCHEMBL6578030 0.83 MAPT (0.52) MRGPRX4PPARGTDP1PPARAMAPT
SCHEMBL6536100 0.82 LMNA (0.54) LMNATDP1MAPTHSD17B10MCL1
SCHEMBL10359783 0.81 PPARG (0.67) MRGPRX4PPARGLMNATDP1MAPT
SCHEMBL1496045 0.81 TDP1 (0.70) MRGPRX4TDP1MAPTRAB9AL3MBTL1
SCHEMBL8903264 0.80 MAPT (0.60) MRGPRX4LMNATDP1PPARAMAPT
Acetic Acid SCHEMBL27488499 0.80 MRGPRX4 (0.56) MRGPRX4LMNATDP1PPARAMAPT
SCHEMBL20023134 0.80 MRGPRX4 (0.57) MRGPRX4PPARGPPARAMAPTS1PR4
Ammonia Solution, Strong SCHEMBL8439387 0.80 TDP1 (0.68) MRGPRX4TDP1MAPTRAB9AL3MBTL1
SCHEMBL9217899 0.79 MAPT (0.54) MRGPRX4LMNATDP1PPARAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025226545-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION PRETZEL THERAPEUTICS, INC. (US) 2025-10-30 WO disclosed
EP-1012140-B1 NEW AMIDINO DERIVATIVES AND THEIR USE AS THROMBIN INHIBITORS ASTRAZENECA AB (SE) 2004-09-29 EP disclosed
US-6576657-B2 Nitrogen containing heterocyclic compounds useful as anticoagulants ASTRAZENECA AB (SE) 2003-06-10 US disclosed
US-20020022612-A1 New amidino derivatives and their use as thrombin inhibitors ASTRAZENECA AB 2002-02-21 US disclosed
US-6265397-B1 Amidino derivatives and their use as thrombin inhibitors ASTRAZENECA AB (SE) 2001-07-24 US disclosed
EP-1012140-A1 NEW AMIDINO DERIVATIVES AND THEIR USE AS THROMBIN INHIBITORS AstraZeneca AB (SE) 2000-06-28 EP disclosed
WO-1998057932-A1 NEW AMIDINO DERIVATIVES AND THEIR USE AS THROMBIN INHIBITORS ASTRA AKTIEBOLAG (SE) 1998-12-23 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-20020022612-A1 New amidino derivatives and their use as thrombin inhibitors SERPINC1, SERPINE1, SERPINB1 MRGPRX4 385/4885PPARG 3276/4885LMNA 986/4885

“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.