SCHEMBL17741702

SCHEMBL17741702

Nc1nc(NCc2ccccc2Cl)n[nH]1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOA P21397 8/20 0.60
KDM1A O60341 3/20 0.59
RCOR1 Q9UKL0 3/20 0.59
SMOX Q9NWM0 3/20 0.59
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50
HSD17B10 Q99714 1/20 0.50
ALDH1A1 P00352 1/20 0.49
POLB P06746 1/20 0.49
GAA P10253 1/20 0.49
GFER P55789 1/20 0.49

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
SCHEMBL17741878 0.81 MAOA (0.64) MAOAKDM1ARCOR1SMOXGAA
SCHEMBL17741890 0.81 MAOA (0.61) MAOAKDM1ARCOR1SMOXHSD17B10
SCHEMBL9818908 0.79 MAOA (0.58) MAOAKDM1ARCOR1SMOXHSD17B10
SCHEMBL17742100 0.78 GAA (0.61) MAOAKDM1ARCOR1SMOXGAA
SCHEMBL14869738 0.77 HRH4 (0.53) CYP3A4CYP2C19HSD17B10ALDH1A1POLB
SCHEMBL7397967 0.74 GAA (0.62) MAOAKDM1ARCOR1SMOXGAA
SCHEMBL17742136 0.74 MAOA (0.52) MAOAKDM1ARCOR1SMOXCYP3A4
SCHEMBL20511447 0.73 TSHR (0.52) CYP3A4CYP2C19HSD17B10ALDH1A1POLB
SCHEMBL10433765 0.72 MAOA (0.62) MAOAKDM1ARCOR1SMOXGAA
SCHEMBL14869364 0.72 FABP4 (0.47) CYP3A4CYP2C19HSD17B10ALDH1A1POLB

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 311/4885KDM1A 1041/4885RCOR1 853/4885

“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.