SCHEMBL10323979

SCHEMBL10323979

COC(=O)c1cc2cnc(SC)nc2[nH]c1=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 5/20 0.45
▸ DYRK1B Q9Y463 5/20 0.45
▸ KDM4E B2RXH2 1/20 0.40
▸ GLA P06280 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ PDE4B Q07343 1/20 0.38
▸ KDM6B O15054 1/20 0.38
▸ KDM4A O75164 1/20 0.38
▸ KDM4D Q6B0I6 1/20 0.38
▸ HIF1AN Q9NWT6 1/20 0.38
▸ KDM2A Q9Y2K7 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ KLK7 P49862 1/20 0.38
▸ SYK P43405 1/20 0.37
▸ CNR2 P34972 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ AHR P35869 1/20 0.36

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
SCHEMBL20589469 0.87 SYK (0.52) GAAALDH1A1SYKMEN1KMT2A
SCHEMBL5458537 0.86 NPC1 (0.45) DYRK1ADYRK1BGAAALDH1A1PDE4B
SCHEMBL10323760 0.86 KDM6B (0.50) DYRK1ADYRK1BKDM4EGAAALDH1A1
SCHEMBL24752055 0.82 ABL1 (0.42) KDM4ETP53
SCHEMBL30853010 0.82 ABL1 (0.42) KDM4ETP53
SCHEMBL5458213 0.82 KDM6B (0.37) DYRK1ADYRK1BPDE4BKDM6BKDM4A
SCHEMBL10323239 0.81 DYRK1A (0.64) DYRK1ADYRK1B
SCHEMBL10323777 0.80 DYRK1A (0.76) DYRK1ADYRK1BTP53RXFP1MEN1
SCHEMBL10322674 0.79 DYRK1A (0.76) DYRK1ADYRK1B
SCHEMBL10446629 0.78 DYRK1A (0.45) DYRK1ADYRK1BKDM4EGLAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11149035-B2 Chemical compounds as H—PGDS inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DFVELOPMENT LIMITED (GB) 2021-10-19 — — US disclosed
US-20200123152-A1 Chemical Compounds as H-PGDS Inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-04-23 — — US disclosed
WO-2012098065-A1 PYRIDO PYRIMIDINES FOR USE AS DYRK1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — WO disclosed
WO-2012098065-A1 PYRIDO PYRIMIDINES FOR USE AS DYRK1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — WO disclosed
US-20120184542-A1 PYRIDO PYRIMIDINES ANDERSON KEVIN (US) 2012-07-19 — — US disclosed
US-20120184542-A1 PYRIDO PYRIMIDINES ANDERSON KEVIN (US) 2012-07-19 — — US disclosed
US-20120184542-A1 PYRIDO PYRIMIDINES ANDERSON KEVIN (US) 2012-07-19 — — 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 (3 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-11149035-B2 Chemical compounds as H—PGDS inhibitors HPGDS, PTGS1, PTGIS DYRK1A 3703/4885DYRK1B 3499/4885KDM4E 1947/4885
US-20200123152-A1 Chemical Compounds as H-PGDS Inhibitors HPGDS, PTGS1, PTGIS DYRK1A 3659/4885DYRK1B 3453/4885KDM4E 1911/4885
US-20120184542-A1 PYRIDO PYRIMIDINES TYMS, TYMP, DPYD DYRK1A 654/4885DYRK1B 570/4885KDM4E 2024/4885

“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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