SCHEMBL17367488

SCHEMBL17367488

COc1cc(-c2sc(Cl)cc2C(N)=O)ccc1-c1ccc(C2(C(C)=O)CC2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.35
LMNA P02545 1/20 0.34
DGAT1 O75907 1/20 0.33
SOAT1 P35610 1/20 0.33
PDE7A Q13946 1/20 0.33
PLAU P00749 1/20 0.33
PLAT P00750 1/20 0.33
MKNK1 Q9BUB5 2/20 0.32
MKNK2 Q9HBH9 2/20 0.32
CTSA P10619 1/20 0.32
F10 P00742 1/20 0.32
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
NEK2 P51955 2/20 0.32
GPR52 Q9Y2T5 1/20 0.32
TGFBR1 P36897 1/20 0.32

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
SCHEMBL17215432 0.92 PRKAB2 (0.39) CHEK1DGAT1SOAT1PLAUPLAT
SCHEMBL15854193 0.88 OPRM1 (0.40) DGAT1SOAT1PDE4D
SCHEMBL18933560 0.86 CHRM1 (0.35) CHEK1DGAT1SOAT1CTSAPDE4D
SCHEMBL17367492 0.86 PRKAB2 (0.39) AKR1C3AKR1C2PRKAB2PRKAG1PRKAA2
SCHEMBL17367480 0.85 PRKAB2 (0.32) CHEK1F10AKR1C3AKR1C2GPR52
SCHEMBL17380949 0.84 CHRM1 (0.35) CHEK1DGAT1SOAT1PDE7ACTSA
SCHEMBL18784645 0.84 CHRM1 (0.35) CHEK1DGAT1SOAT1PDE7ACTSA
SCHEMBL17367483 0.83 ACHE (0.31)
SCHEMBL17367482 0.82 MAPT (0.33) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL17367493 0.80 LPAR1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150376160-A1 HALOGEN-SUBSTITUTED HETEROCYCLIC COMPOUND UBE INDUSTRIES, LTD. (JP) 2015-12-31 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-20150376160-A1 HALOGEN-SUBSTITUTED HETEROCYCLIC COMPOUND LPAR3, LPAR1, LPAR2 CHEK1 3087/4885LMNA 2850/4885DGAT1 511/4885

“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.