SCHEMBL17593117

SCHEMBL17593117

O=C(Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1)c1cc(-c2ccccc2)n[nH]1

nearest known ligand 0.81

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PHGDH O43175 1/20 0.81
▸ IDE P14735 1/20 0.67
▸ KDM4E B2RXH2 5/20 0.59
▸ POLB P06746 3/20 0.56
▸ TP53 P04637 2/20 0.56
▸ MEN1 O00255 3/20 0.56
▸ KMT2A Q03164 3/20 0.56
▸ ALDH1A1 P00352 3/20 0.56
▸ DPP4 P27487 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ GAA P10253 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ CNR1 P21554 1/20 0.54
▸ RXFP1 Q9HBX9 1/20 0.53
▸ THRB P10828 1/20 0.53

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
SCHEMBL17592960 0.87 LMNA (0.69) PHGDHIDEKDM4EPOLBMEN1
SCHEMBL17593234 0.87 IDE (0.67) PHGDHIDEKDM4EPOLBTP53
SCHEMBL17593329 0.85 IDE (0.68) PHGDHIDEKDM4EPOLBTP53
SCHEMBL17593188 0.84 IDE (0.69) PHGDHIDEKDM4EPOLBTP53
SCHEMBL17593316 0.83 IDE (0.67) PHGDHIDEKDM4EPOLBMEN1
SCHEMBL17593266 0.82 IDE (0.60) PHGDHIDEKDM4EPOLBTP53
SCHEMBL17593212 0.81 PHGDH (0.66) PHGDHIDEKDM4ETP53MEN1
SCHEMBL17593045 0.80 IDE (1.00) PHGDHIDEKDM4EPOLBMEN1
SCHEMBL17593090 0.80 ALDH1A1 (0.62) PHGDHKDM4EPOLBTP53MEN1
SCHEMBL27716724 0.79 ACR (0.70) PHGDHKDM4EPOLBTP53ALDH1A1

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-20220400732-A1 ANTI-FRUCTOSE THERAPY FOR COLORECTAL AND SMALL INTESTINE CANCERS CORNELL UNIVERSITY 2022-12-22 — — US disclosed
WO-2016040449-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. (US) 2016-03-17 — — 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-20220400732-A1 ANTI-FRUCTOSE THERAPY FOR COLORECTAL AND SMALL INTESTINE CANCERS KHK, GCK, FN3K PHGDH 275/4885IDE 792/4885KDM4E 1055/4885

“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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