SCHEMBL19782926

SCHEMBL19782926

COc1cc(/C=C/C(=O)c2ccccc2Cl)ccc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL12 P48061 8/20 1.00
PTGS1 P23219 2/20 0.79
PTGS2 P35354 2/20 0.79
AR P10275 2/20 0.71
MAOB P27338 2/20 0.67
ACHE P22303 1/20 0.67
ABCG2 Q9UNQ0 1/20 0.67
CHRNA7 P36544 1/20 0.67
MAOA P21397 1/20 0.66
NFKB1 P19838 2/20 0.65
NFKB2 Q00653 2/20 0.65
RELA Q04206 2/20 0.65
CXCR4 P61073 1/20 0.65
MEN1 O00255 1/20 0.65
KMT2A Q03164 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
CYP1A2 P05177 1/20 0.62
ALOX5 P09917 1/20 0.62
CYP2D6 P10635 1/20 0.62
HSD11B1 P28845 1/20 0.62

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
SCHEMBL25196746 0.90 CXCL12 (0.81) CXCL12PTGS1PTGS2ARMAOB
SCHEMBL25245508 0.90 CXCL12 (0.81) CXCL12PTGS1PTGS2ARMAOB
SCHEMBL25191295 0.88 PTGS1 (0.85) CXCL12PTGS1PTGS2ARMAOB
SCHEMBL29427953 0.88 PTGS1 (1.00) CXCL12PTGS1PTGS2ARMAOB
SCHEMBL3396596 0.88 PTGS1 (1.00) CXCL12PTGS1PTGS2ARMAOB
SCHEMBL3396591 0.88 PTGS1 (1.00) CXCL12PTGS1PTGS2ARMAOB
SCHEMBL25195740 0.88 PTGS1 (1.00) CXCL12PTGS1PTGS2ARMAOB
SCHEMBL25202024 0.86 CXCL12 (0.76) CXCL12PTGS1PTGS2ARMAOB
SCHEMBL25199657 0.86 CXCL12 (1.00) CXCL12PTGS1PTGS2ARCHRNA7
SCHEMBL25195162 0.86 PTGS1 (0.81) CXCL12PTGS1PTGS2ARMAOB

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
US-11046657-B2 Pyrimidinone derivatives and uses thereof to neutralize the biological activity of chemokines CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2021-06-29 US disclosed
US-11046657-B2 Pyrimidinone derivatives and uses thereof to neutralize the biological activity of chemokines CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2021-06-29 US disclosed
US-20200181093-A1 Pyrimidinone Derivatives and Uses Thereof to Neutralize the Biological Activity of Chemokines CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS (FR) 2020-06-11 US disclosed
US-20200181093-A1 Pyrimidinone Derivatives and Uses Thereof to Neutralize the Biological Activity of Chemokines CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS (FR) 2020-06-11 US disclosed
EP-3484864-A1 PYRIMIDINONE DERIVATIVES AND USES THEREOF TO NEUTRALIZE THE BIOLOGICAL ACTIVITY OF CHEMOKINES Centre National de la Recherche Scientifique - CNRS (FR) 2019-05-22 EP disclosed
WO-2018011376-A1 PYRIMIDINONE DERIVATIVES AND USES THEREOF TO NEUTRALIZE THE BIOLOGICAL ACTIVITY OF CHEMOKINES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE - CNRS - (FR) 2018-01-18 WO disclosed
WO-2018011376-A1 PYRIMIDINONE DERIVATIVES AND USES THEREOF TO NEUTRALIZE THE BIOLOGICAL ACTIVITY OF CHEMOKINES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE - CNRS - (FR) 2018-01-18 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 (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-20200181093-A1 Pyrimidinone Derivatives and Uses Thereof to Neutralize the Biological Activity of Chemokines CCL5, CXCR3, CXCL10 CXCL12 18/4885PTGS1 178/4885PTGS2 376/4885
US-11046657-B2 Pyrimidinone derivatives and uses thereof to neutralize the biological activity of chemokines CCL5, CXCR3, CXCL10 CXCL12 18/4885PTGS1 178/4885PTGS2 376/4885

“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.