SCHEMBL20150746

SCHEMBL20150746

CCc1nn(C(C)c2ccc(OC(F)(F)F)cc2)c(N)c1C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 11/20 0.49
GCGR P47871 4/20 0.43
GIPR P48546 1/20 0.40
EPHX1 P07099 2/20 0.38
GPR139 Q6DWJ6 1/20 0.38
ALDH1A1 P00352 1/20 0.37
PLA2G10 O15496 1/20 0.37
PLA2G2A P14555 1/20 0.37
PLA2G5 P39877 1/20 0.37

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
SCHEMBL18291854 0.90 PDE2A (0.55) PDE2AGCGRGIPREPHX1
SCHEMBL18290659 0.87 PDE2A (0.53) PDE2AGCGRGIPREPHX1GPR139
SCHEMBL20150753 0.86 PDE2A (0.46) PDE2AGPR139ALDH1A1
SCHEMBL20150749 0.85 PDE2A (0.52) PDE2A
SCHEMBL18291879 0.85 PDE2A (0.52) PDE2AGCGRGIPREPHX1ALDH1A1
SCHEMBL20150743 0.85 PDE2A (0.56) PDE2AGPR139
SCHEMBL20138434 0.84 PDE2A (0.71) PDE2AGCGRGIPREPHX1ALDH1A1
SCHEMBL20150754 0.83 PDE2A (0.48) PDE2AALDH1A1
SCHEMBL20150745 0.83 PDE2A (0.46) PDE2AALDH1A1
SCHEMBL20150751 0.82 PDE2A (0.46) PDE2AGCGREPHX1ALDH1A1

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-20180134712-A1 6-ALKYL DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-05-17 US disclosed
US-20180134712-A1 6-ALKYL DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-05-17 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-20180134712-A1 6-ALKYL DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS PDE12, PDE2A, PDE4D PDE2A 2/4885GCGR 984/4885GIPR 1033/4885

“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.