SCHEMBL20182650

SCHEMBL20182650

CN1c2ncncc2C(=O)NC1O

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 3/20 0.37
CYP2D6 P10635 8/20 0.33
CYP1A2 P05177 7/20 0.33
CYP3A4 P08684 7/20 0.33
TSHR P16473 4/20 0.33
HSD17B10 Q99714 3/20 0.33
ALDH1A1 P00352 2/20 0.33
TNKS2 Q9H2K2 3/20 0.32
CLK4 Q9HAZ1 1/20 0.32
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
CYP2C19 P33261 3/20 0.31
RECQL P46063 1/20 0.31
CDC25B P30305 1/20 0.30
CYP2C9 P11712 1/20 0.30
MAPK1 P28482 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL26777524 0.77 HSP90AA1 (0.32) CYP2D6CYP1A2CYP3A4TSHRHSD17B10
SCHEMBL20182449 0.72 ADORA3 (0.36) MKNK2CYP3A4TSHRHSD17B10ALDH1A1
SCHEMBL28570261 0.71 CYP2D6 (0.38) MKNK2CYP2D6CYP1A2CYP3A4TSHR
SCHEMBL30656419 0.71 CYP2D6 (0.38) MKNK2CYP2D6CYP1A2CYP3A4TSHR
SCHEMBL20182463 0.69 TNKS2 (0.32) TNKS2
SCHEMBL20182601 0.69 ADORA3 (0.38) CYP3A4TSHRHSD17B10ALDH1A1MEN1
SCHEMBL18545322 0.68 GDA (0.43) MEN1KMT2A
SCHEMBL19035767 0.68 GDA (0.30)
SCHEMBL26644771 0.65 MKNK2 (0.36) MKNK2TNKS2CDC25B
SCHEMBL26644767 0.65 CYP1A2 (0.33) MKNK2CYP2D6CYP1A2CYP3A4TSHR

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-10278973-B2 Hydroxyl purine compounds and use thereof Guangdong Raynovent Biotech Co., Ltd. (CN) 2019-05-07 US disclosed
US-20180140607-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF Guangdong Raynovent Biotech Co., Ltd. (CN) 2018-05-24 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-20180140607-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF PNP, PDE7A, PDE2A MKNK2 3178/4885CYP2D6 508/4885CYP1A2 98/4885
US-10278973-B2 Hydroxyl purine compounds and use thereof PNP, PDE7A, PDE2A MKNK2 3178/4885CYP2D6 508/4885CYP1A2 98/4885

“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.