SCHEMBL20185343

SCHEMBL20185343

CC(C)C(c1ccc(OC(F)(F)F)cc1)n1nc(COCc2ccccc2)c(C(N)=O)c1N

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 4/20 0.61
EPHX1 P07099 2/20 0.40
TP53 P04637 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
RECQL P46063 1/20 0.37
AR P10275 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GPR139 Q6DWJ6 2/20 0.36
GCGR P47871 1/20 0.36
PTGER4 P35408 1/20 0.36
SCN10A Q9Y5Y9 2/20 0.36
PLA2G10 O15496 3/20 0.36
PLA2G2A P14555 3/20 0.36
PLA2G5 P39877 3/20 0.36
RET P07949 1/20 0.35

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
SCHEMBL20138434 0.91 PDE2A (0.71) PDE2AEPHX1TP53ALDH1A1GAA
SCHEMBL20138417 0.89 PDE2A (0.66) PDE2AARRET
SCHEMBL20202563 0.87 PDE2A (0.60) PDE2AALDH1A1RECQLRET
SCHEMBL18290592 0.86 PDE2A (0.46) PDE2AEPHX1ALDH1A1GPR139GCGR
SCHEMBL18290599 0.84 PDE2A (0.48) PDE2AEPHX1ALDH1A1GPR139GCGR
SCHEMBL20138405 0.80 PDE2A (0.79) PDE2AGPR139
SCHEMBL18282926 0.80 PDE2A (0.76) PDE2ARET
SCHEMBL20138449 0.79 PDE2A (0.67) PDE2AGPR139PLA2G10PLA2G2ARET
SCHEMBL20581431 0.78 PDE2A (0.74) PDE2AEPHX1ALDH1A1RET
SCHEMBL20138450 0.78 PDE2A (0.71) PDE2ARET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3302486-B1 DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME (US) 2020-09-30 EP disclosed
EP-3302486-B1 DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME (US) 2020-09-30 EP disclosed
US-10174037-B2 Dihydropyrazolopyrimidinone compounds as PDE2 inhibitors MERCK SHARP & DOHME CORP. (US) 2019-01-08 US disclosed
US-10174037-B2 Dihydropyrazolopyrimidinone compounds as PDE2 inhibitors MERCK SHARP & DOHME CORP. (US) 2019-01-08 US disclosed
US-20180148453-A1 DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-05-31 US disclosed
US-20180148453-A1 DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-05-31 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 (2 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-20180148453-A1 DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS PDE12, PDE2A, PDE4D PDE2A 2/4885EPHX1 945/4885TP53 4186/4885
US-10174037-B2 Dihydropyrazolopyrimidinone compounds as PDE2 inhibitors PDE12, PDE2A, PDE4D PDE2A 2/4885EPHX1 945/4885TP53 4186/4885

“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.