SCHEMBL20185362

SCHEMBL20185362

N#Cc1c(COCc2ccccc2)nn(Cc2ccc(C(F)(F)F)cc2)c1N

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
GHSR Q92847 3/20 0.42
PTGDR2 Q9Y5Y4 3/20 0.36
GAA P10253 2/20 0.36
IDO1 P14902 2/20 0.35
PDE2A O00408 1/20 0.35
POLB P06746 1/20 0.34
TACR1 P25103 1/20 0.34
CTSK P43235 1/20 0.34
MAOB P27338 1/20 0.34
PTGER4 P35408 1/20 0.34

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
SCHEMBL20207772 0.80 PDE2A (0.52) GHSRPTGDR2GAAPDE2AMAOB
SCHEMBL6197245 0.79 TSHR (0.50) TSHRGHSRGAACTSKMAOB
SCHEMBL6201447 0.78 TSHR (0.48) TSHRGHSRGAAPOLB
SCHEMBL31194571 0.74 TSHR (0.70) TSHRGAAPOLB
SCHEMBL3716061 0.74 TSHR (0.43) TSHRGHSRGAAPDE2ACTSK
SCHEMBL20500103 0.71 CTSL (0.41) TSHRGHSRGAACTSK
SCHEMBL20581457 0.69 PDE2A (0.49) PDE2A
SCHEMBL7303767 0.69 TSHR (1.00) TSHRGAAPOLB
SCHEMBL18282716 0.68 PDE2A (0.71) PDE2A
SCHEMBL22475620 0.68 MEN1 (0.39) TSHRGHSRPTGDR2PDE2APOLB

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 3 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
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

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 TSHR 2910/4885GHSR 1735/4885PTGDR2 71/4885
US-10174037-B2 Dihydropyrazolopyrimidinone compounds as PDE2 inhibitors PDE12, PDE2A, PDE4D TSHR 2910/4885GHSR 1735/4885PTGDR2 71/4885

“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.