SCHEMBL22554098

SCHEMBL22554098

O=C(O)CNC(=O)c1cc2c(Br)ccnc2[nH]1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.45
NUDT1 P36639 5/20 0.44
EGLN2 Q96KS0 1/20 0.43
FTO Q9C0B1 1/20 0.43
EGLN1 Q9GZT9 3/20 0.42
CCNK O75909 3/20 0.40
CDK12 Q9NYV4 3/20 0.40
HTR1A P08908 1/20 0.40
GABRA1 P14867 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
SCHEMBL22554174 0.88 NUDT1 (0.43) NUDT1CCNKCDK12HTR1AGABRA1
SCHEMBL30731058 0.83 NUDT1 (0.42) NUDT1CCNKCDK12HTR1AGABRA1
SCHEMBL22570933 0.83 NUDT1 (0.42) NUDT1CCNKCDK12HTR1AGABRA1
SCHEMBL22554070 0.81 DAO (0.44) DAONUDT1CCNKCDK12
SCHEMBL30731002 0.81 DAO (0.44) DAONUDT1CCNKCDK12
SCHEMBL22554207 0.77 NAMPT (0.45) NUDT1CCNKCDK12
SCHEMBL30731054 0.74 ABL1 (0.44) DAONUDT1
SCHEMBL22554309 0.74 ABL1 (0.44) DAONUDT1
SCHEMBL3416746 0.74 PRKCI (0.40) DAONUDT1CCNKCDK12GABRA1
SCHEMBL30731078 0.73 NUDT1 (0.48) NUDT1

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-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors HIBERCELL, INC. (US) 2024-03-05 US disclosed
CN-112088157-A Aryl-bipyridine amine derivatives as phosphoinositide kinase inhibitors 拉文纳制药公司 2020-12-15 CN disclosed
EP-3728230-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS Ravenna Pharmaceuticals, Inc. (US) 2020-10-28 EP disclosed
US-20200331913-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS HIBERCELL, INC. 2020-10-22 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-20200331913-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS PIP5K1A, PIP5K1B, PIP5K1C DAO 3277/4885NUDT1 2148/4885EGLN2 4173/4885
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors PIP5K1A, PIP5K1B, PIP5K1C DAO 3277/4885NUDT1 2148/4885EGLN2 4173/4885

“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.