SCHEMBL18285548

SCHEMBL18285548

COc1nc(Cl)c(C(=O)COCc2ccccc2)c(OC)n1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.38
▸ MAPT P10636 1/20 0.38
▸ CSNK1D P48730 2/20 0.36
▸ GRM5 P41594 4/20 0.36
▸ PDE4A P27815 1/20 0.36
▸ ADORA3 P0DMS8 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ ADORA1 P30542 1/20 0.36
▸ FAAH O00519 1/20 0.35
▸ CES1 P23141 1/20 0.35
▸ PIN1 Q13526 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ MCL1 Q07820 1/20 0.34
▸ BAK1 Q16611 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
SCHEMBL18282836 0.89 NPC1 (0.38) NPC1MAPTCSNK1DGRM5PDE4A
SCHEMBL22171639 0.72 GRM5 (0.40) NPC1MAPTGRM5POLBMEN1
SCHEMBL27032877 0.71 KMT2A (0.48) NPC1POLBRAB9AKMT2AALDH1A1
SCHEMBL12095430 0.69 PARP10 (0.47) MAPTPOLBALDH1A1
SCHEMBL9653413 0.66 NPC1 (0.65) NPC1MAPTCES1POLBRAB9A
SCHEMBL18068866 0.66 NPC1 (0.56) NPC1RAB9AKMT2AALDH1A1
SCHEMBL29639749 0.66 NPC1 (0.50) NPC1MAPTRAB9AKMT2AALDH1A1
SCHEMBL657234 0.66 TDP1 (0.55) NPC1MAPTGRM5CES1RAB9A
SCHEMBL9650496 0.66 MAPT (0.62) NPC1MAPTGRM5CES1RAB9A
SCHEMBL9218086 0.66 SLC5A1 (0.61) NPC1MAPTPOLBRAB9AMEN1

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 9 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
US-20180148453-A1 DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-05-31 — — US disclosed
EP-3302486-A1 DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS Merck Sharp & Dohme Corp. (US) 2018-04-11 — — EP disclosed
WO-2016196417-A1 DIHYDROPYRAZOLOPYRIMIDINONE COMPOUNDS AS PDE2 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-12-08 — — WO 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 NPC1 3559/4885MAPT 589/4885CSNK1D 757/4885
US-10174037-B2 Dihydropyrazolopyrimidinone compounds as PDE2 inhibitors PDE12, PDE2A, PDE4D NPC1 3559/4885MAPT 589/4885CSNK1D 757/4885

“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.

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