SCHEMBL22925558

SCHEMBL22925558

N/C(=N/O)c1ccc(Nc2nnc(-c3ccc(Cl)cn3)o2)cn1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 6/20 0.37
ATR Q13535 2/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
QPCT Q16769 1/20 0.35
ACHE P22303 1/20 0.34
HDAC1 Q13547 1/20 0.34
DGAT1 O75907 1/20 0.33
SPHK2 Q9NRA0 1/20 0.32
FLT1 P17948 1/20 0.32
KDR P35968 1/20 0.32
KDM4E B2RXH2 1/20 0.31
DHODH Q02127 1/20 0.31
VCP P55072 1/20 0.31
MAOB P27338 1/20 0.31

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
SCHEMBL31013352 1.00 GSK3B (0.37) GSK3BATRCA12CA1CA2
SCHEMBL28733614 1.00 GSK3B (0.37) GSK3BATRCA12CA1CA2
Hydrochloric Acid SCHEMBL29696318 0.99 GSK3B (0.37) GSK3BATRCA12CA1CA2
SCHEMBL22925799 0.87 RAB9A (0.38) GSK3BATRACHEHDAC1DGAT1
SCHEMBL29696283 0.84 NPSR1 (0.43) GSK3BFLT1KDRKDM4E
SCHEMBL22925724 0.84 NPSR1 (0.43) GSK3BFLT1KDRKDM4E
SCHEMBL22925730 0.83 VCP (0.44) DGAT1FLT1KDRVCPMAOB
SCHEMBL29621023 0.83 VCP (0.44) DGAT1FLT1KDRVCPMAOB
SCHEMBL28939255 0.83 VCP (0.44) DGAT1FLT1KDRVCPMAOB
Hydrochloric Acid SCHEMBL28733807 0.83 NPSR1 (0.42) GSK3BFLT1KDRKDM4E

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-20220274970-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2022-09-01 US disclosed
WO-2021012018-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2021-01-28 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-20220274970-A1 INHIBITOR COMPOUNDS SERPINB1, MMP1, SSB GSK3B 605/4885ATR 3946/4885CA12 4592/4885

“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.