SCHEMBL1367408

SCHEMBL1367408

CC(C(=O)O)c1cnc(C(=O)c2ccc(OCCc3ccc(Cl)cc3)cc2)c2ccccc12

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 8/20 0.69
PPARG P37231 6/20 0.48
TAAR1 Q96RJ0 1/20 0.43
PPARA Q07869 4/20 0.41
PPARD Q03181 3/20 0.41
FFAR1 O14842 1/20 0.40
PTGER4 P35408 1/20 0.39
PLA2G4A P47712 1/20 0.39

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
SCHEMBL1367229 0.89 PTGDR2 (0.55) PTGDR2PPARG
SCHEMBL1369743 0.84 PTGDR2 (0.48) PTGDR2PPARGTAAR1PPARAPPARD
SCHEMBL1369565 0.83 PTGDR2 (0.70) PTGDR2PPARGPPARAPPARD
SCHEMBL1369469 0.82 PTGDR2 (1.00) PTGDR2
SCHEMBL1369878 0.82 PTGDR2 (0.70) PTGDR2FFAR1
SCHEMBL1369884 0.80 PTGDR2 (0.53) PTGDR2
SCHEMBL1367423 0.80 PTGDR2 (0.44) PTGDR2
SCHEMBL1366643 0.79 PTGDR2 (0.45) PTGDR2PPARGPPARA
SCHEMBL1369027 0.76 PTGS1 (0.48) PTGDR2
SCHEMBL1369033 0.75 PTGS1 (0.44) PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110288293-A1 ISOQUINOLINE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-11-24 US disclosed
EP-2377851-A1 ISOQUINOLINE DERIVATIVE Taisho Pharmaceutical Co., Ltd. (JP) 2011-10-19 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-20110288293-A1 ISOQUINOLINE DERIVATIVE HRH1, HRH2, HRH4 PTGDR2 189/4885PPARG 1874/4885TAAR1 1203/4885

“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.