SCHEMBL30729970

SCHEMBL30729970

CCOc1cnc(N)nc1OC

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 2/20 0.49
DHFR P00374 1/20 0.47
P2RX3 P56373 4/20 0.44
P2RX2 Q9UBL9 4/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.40
KMT2A Q03164 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
SCHEMBL27035942 1.00 NUDT1 (0.49) NUDT1DHFRP2RX3P2RX2MAPT
SCHEMBL27532126 0.89 NUDT1 (0.47) NUDT1DHFRP2RX3P2RX2MAPT
SCHEMBL2897696 0.84 NUDT1 (0.58) NUDT1DHFRP2RX3P2RX2MEN1
SCHEMBL27053669 0.82 NUDT1 (0.47) NUDT1P2RX3P2RX2
SCHEMBL27150294 0.82 NUDT1 (0.43) NUDT1DHFRP2RX3P2RX2MAPT
SCHEMBL26978045 0.81 NUDT1 (0.46) NUDT1DHFRP2RX3P2RX2MEN1
SCHEMBL31615264 0.80 NUDT1 (0.44) NUDT1DHFRP2RX3P2RX2MEN1
SCHEMBL29082598 0.80 NUDT1 (0.51) NUDT1P2RX3P2RX2MAPTMEN1
SCHEMBL30559743 0.80 NUDT1 (0.44) NUDT1DHFRP2RX3P2RX2MEN1
SCHEMBL30559753 0.80 NUDT1 (0.44) NUDT1DHFRP2RX3P2RX2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240025883-A1 PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-01-25 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-20240025883-A1 PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES GPR17, GPR27, GPR119 NUDT1 2813/4885DHFR 2001/4885P2RX3 120/4885

“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.