SCHEMBL2302703

SCHEMBL2302703

O=C(O)CC(Cc1nc2ccc(Cl)cc2[nH]1)c1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 9/20 1.00
CHEK2 O96017 2/20 0.45
ITGAV P06756 2/20 0.44
ITGB6 P18564 2/20 0.44
ITGB8 P26012 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
RAB9A P51151 2/20 0.43
HSD17B10 Q99714 1/20 0.43
PIN1 Q13526 2/20 0.42
ITGB3 P05106 1/20 0.38
ITGB5 P18084 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38

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
SCHEMBL2302698 0.92 PRKCZ (0.85) PRKCZCHEK2ITGAVITGB6ITGB8
Hydrochloric Acid SCHEMBL656242 0.91 PRKCZ (0.84) PRKCZCHEK2ITGAVITGB6ITGB8
SCHEMBL2303921 0.88 PRKCZ (1.00) PRKCZTDP1RAB9AHSD17B10PIN1
SCHEMBL2303159 0.87 PRKCZ (0.82) PRKCZTDP1RAB9AHSD17B10PIN1
SCHEMBL659484 0.85 PRKCZ (0.83) PRKCZTDP1RAB9AHSD17B10PIN1
SCHEMBL2304114 0.83 PRKCZ (0.72) PRKCZTDP1RAB9AHSD17B10EGLN1
SCHEMBL2302726 0.82 PRKCZ (0.78) PRKCZTDP1RAB9AHSD17B10PIN1
SCHEMBL2304303 0.82 PRKCZ (0.78) PRKCZTDP1RAB9AHSD17B10PIN1
SCHEMBL2303603 0.82 PRKCZ (0.77) PRKCZTDP1RAB9AHSD17B10PIN1
SCHEMBL2303149 0.81 PRKCZ (0.77) PRKCZTDP1RAB9AHSD17B10PIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2349999-A1 ALLOSTERIC PROTEIN KINASE MODULATORS Universität des Saarlandes (DE) 2011-08-03 EP claimed
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO claimed
US-8912186-B2 Allosteric protein kinase modulators UNIVERSITAET DES SAARLANDES (DE) 2014-12-16 US disclosed
US-8912186-B2 Allosteric protein kinase modulators UNIVERSITAET DES SAARLANDES (DE) 2014-12-16 US disclosed
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2012-02-23 US disclosed
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2012-02-23 US disclosed
EP-2349999-A1 ALLOSTERIC PROTEIN KINASE MODULATORS Universität des Saarlandes (DE) 2011-08-03 EP disclosed
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO disclosed
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO disclosed
EP-2177510-A1 Allosteric protein kinase modulators Universität des Saarlandes (DE) 2010-04-21 EP 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-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS AURKC, AURKA, AURKB PRKCZ 26/4885CHEK2 59/4885ITGAV 4196/4885

“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.