SCHEMBL3751015

SCHEMBL3751015

CCCNc1nc(Nc2ccccc2)c2cnn(C)c2n1

nearest known ligand 0.77

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.77
TP53 P04637 1/20 0.77
MEN1 O00255 3/20 0.68
KMT2A Q03164 3/20 0.68
BCDIN3D Q7Z5W3 13/20 0.67
HTR2C P28335 1/20 0.67
SHMT2 P34897 2/20 0.61
KDM4E B2RXH2 1/20 0.57
ALDH1A1 P00352 1/20 0.57
MAPK1 P28482 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57

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
SCHEMBL13943305 0.89 MEN1 (0.73) MAPTTP53MEN1KMT2ABCDIN3D
SCHEMBL13942957 0.88 MEN1 (0.75) MAPTTP53MEN1KMT2ABCDIN3D
SCHEMBL13943739 0.88 TP53 (0.70) MAPTTP53MEN1KMT2ABCDIN3D
SCHEMBL13943737 0.87 TP53 (0.72) MAPTTP53BCDIN3DHTR2CSHMT2
SCHEMBL13944369 0.87 MEN1 (0.67) MAPTTP53MEN1KMT2ABCDIN3D
SCHEMBL13943297 0.86 SHMT2 (0.82) MAPTTP53MEN1KMT2ABCDIN3D
SCHEMBL4053549 0.86 KMT2A (0.66) MAPTTP53MEN1KMT2ABCDIN3D
SCHEMBL13943702 0.86 TP53 (0.67) MAPTTP53MEN1KMT2ABCDIN3D
SCHEMBL13943734 0.85 TP53 (0.70) MAPTTP53MEN1KMT2ABCDIN3D
SCHEMBL13943710 0.84 TP53 (0.69) MAPTTP53MEN1KMT2ABCDIN3D

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8232279-B2 Pyrazolopyrimidine derivatives having biological activity on serotonin receptor 5-HT2c KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2012-07-31 US claimed
US-20100298563-A1 PYRAZOLOPYRIMIDINE DERIVATIVES HAVING BIOLOGICAL ACTIVITY ON SEROTONIN RECEPTOR 5-HT2c KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2010-11-25 US claimed
US-8232279-B2 Pyrazolopyrimidine derivatives having biological activity on serotonin receptor 5-HT2c KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2012-07-31 US disclosed
US-20100298563-A1 PYRAZOLOPYRIMIDINE DERIVATIVES HAVING BIOLOGICAL ACTIVITY ON SEROTONIN RECEPTOR 5-HT2c KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2010-11-25 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 (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-20100298563-A1 PYRAZOLOPYRIMIDINE DERIVATIVES HAVING BIOLOGICAL ACTIVITY ON SEROTONIN RECEPTOR 5-HT2c HTR2C, HTR5A, HTR3C MAPT 1410/4885TP53 4813/4885MEN1 4712/4885

“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.