SCHEMBL20185490

SCHEMBL20185490

CC(C)(C)OC(=O)NN=C(c1ccc(C(C)(C)C)cc1)C1CC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 1/20 0.42
MAPT P10636 4/20 0.41
NPC1 O15118 5/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 2/20 0.40
MEN1 O00255 1/20 0.40
ESRRG P62508 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HDAC1 Q13547 1/20 0.40
MIF P14174 1/20 0.37
GAA P10253 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
SCHEMBL20202546 0.86 RAB9A (0.48) RAB9AALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL20185549 0.83 RAB9A (0.46) RAB9AALDH1A1HPGDMAPTNPC1
SCHEMBL20185551 0.83 RAB9A (0.46) RAB9AALDH1A1HPGDMAPTNPC1
SCHEMBL11046721 0.72 RAB9A (0.43) RAB9AALDH1A1HPGDNPC1SMN1; SMN2
SCHEMBL11046718 0.72 RAB9A (0.43) RAB9AALDH1A1HPGDNPC1SMN1; SMN2
SCHEMBL11046726 0.72 RAB9A (0.43) RAB9AALDH1A1HPGDNPC1SMN1; SMN2
SCHEMBL20583674 0.70 NPC1 (0.43) RAB9AALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL20583676 0.70 NPC1 (0.43) RAB9AALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL13605085 0.69 MAPT (0.63) RAB9AALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL20339566 0.69 L3MBTL1 (0.56) RAB9AALDH1A1MAPTNPC1SMN1; SMN2

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 RAB9A 700/4885ALDH1A1 635/4885HPGD 58/4885
US-10174037-B2 Dihydropyrazolopyrimidinone compounds as PDE2 inhibitors PDE12, PDE2A, PDE4D RAB9A 700/4885ALDH1A1 635/4885HPGD 58/4885

“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.