SCHEMBL17741783

SCHEMBL17741783

COc1ccc(CNc2n[nH]c(N)n2)c(F)c1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 10/20 0.55
▸ SMOX Q9NWM0 3/20 0.48
▸ KDM1A O60341 4/20 0.45
▸ RCOR1 Q9UKL0 3/20 0.45
▸ CHRM4 P08173 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ LCK P06239 1/20 0.41
▸ BTK Q06187 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40

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
SCHEMBL17742134 0.90 MAOA (0.55) MAOASMOXKDM1ARCOR1GAA
SCHEMBL17741698 0.83 MAOA (0.46) MAOASMOXKDM1ARCOR1LCK
SCHEMBL17741703 0.82 MAOA (0.57) MAOASMOXKDM1ARCOR1
SCHEMBL17731498 0.79 MEN1 (0.55) MAOASMOX
SCHEMBL17742131 0.77 ADORA2A (0.58) MAOASMOXKDM1ARCOR1HSD17B10
SCHEMBL17741878 0.76 MAOA (0.64) MAOASMOXKDM1ARCOR1GAA
SCHEMBL17742090 0.75 MAOA (0.56) MAOASMOXKDM1ARCOR1
SCHEMBL17742133 0.74 MAOA (0.57) MAOASMOXKDM1ARCOR1GAA
SCHEMBL13407800 0.71 KDM1A (0.52) MAOAKDM1ACHRM4MAOBGAA
SCHEMBL17742091 0.71 MAOA (0.47) MAOASMOXGAA

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-10239882-B2 Substituted 5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine compounds as PDE2 inhibitors DART NEUROSCIENCE (CAYMAN) LTD. (KY) 2019-03-26 — — US disclosed
WO-2016073424-A1 SUBSTITUTED 5-METHYL-[1, 2, 4] TRIAZOLO [1,5-A) PYRIMIDIN-2-AMINE COMPOUNDS AS PDE2 INHIBITORS DART NEUROSCIENCE, LLC (US) 2016-05-12 — — 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 (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-10239882-B2 Substituted 5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine compounds as PDE2 inhibitors PDE12, PDE2A, PDE3A MAOA 311/4885SMOX 1960/4885KDM1A 1041/4885

“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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