SCHEMBL16624229

SCHEMBL16624229

CC(C)Oc1c(C=O)cc(C2CC2)c(C2CCC2)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.36
PTGDR Q13258 1/20 0.36
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31

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
SCHEMBL17535692 0.97 PTGDR2 (0.32) PTGDR2PTGDR
SCHEMBL17535516 0.82 ERN1 (0.33)
SCHEMBL16056076 0.81 ALOX5AP (0.34) ALOX5APFEN1
SCHEMBL17535812 0.78 ALDH1A1 (0.36)
SCHEMBL16616530 0.76 SSTR5 (0.35) ALOX5APFEN1
SCHEMBL16055991 0.76 PTGDR2 (0.35) PTGDR2PTGDR
SCHEMBL16616179 0.75 PTGDR2 (0.37) PTGDR2PTGDRALOX5APFEN1
SCHEMBL16670157 0.73 GRM2 (0.34) ALOX5APFEN1
SCHEMBL16056478 0.73 PTGDR2 (0.32) PTGDR2PTGDR
SCHEMBL17535473 0.73 PTGDR2 (0.35) PTGDR2PTGDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9353108-B2 Tetrahydronaphthyridine somatostatin receptor 5 antagonists TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-05-31 US disclosed
US-9353108-B2 Tetrahydronaphthyridine somatostatin receptor 5 antagonists TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-05-31 US disclosed
US-20150099777-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-04-09 US disclosed
US-20150099777-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-04-09 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-20150099777-A1 HETEROCYCLIC COMPOUND SSTR5, SSTR4, SSTR2 PTGDR2 419/4885PTGDR 267/4885ALOX5AP 1142/4885

“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.