SCHEMBL22979290

SCHEMBL22979290

CC(C)N(C(=O)OC(C)(C)C)[C@H](C)C(N)=O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.33
CA14 Q9ULX7 1/20 0.33
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 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
SCHEMBL12261426 0.83 HDAC6 (0.36) CA12CA14HDAC1HDAC2HDAC6
SCHEMBL22186495 0.82 KMT2A (0.33) CA12CA14HDAC1HDAC2HDAC6
SCHEMBL16104875 0.79 NFKB1 (0.31) CA12CA14HDAC1HDAC2HDAC6
SCHEMBL13731788 0.78 AAK1 (0.35) CA12CA14HDAC1HDAC2HDAC6
SCHEMBL8386740 0.78 AAK1 (0.35) CA12CA14HDAC1HDAC2HDAC6
SCHEMBL11165565 0.74 GABRP (0.37) CA12CA14HDAC1HDAC2HDAC6
SCHEMBL8269707 0.74
SCHEMBL2499624 0.74 KMT2A (0.34) CA14HDAC1HDAC2HDAC6CA1
SCHEMBL18658420 0.73 CA14 (0.34) CA12CA14HDAC1HDAC2HDAC6
SCHEMBL503445 0.73 HDAC6 (0.35) CA12CA14HDAC1HDAC2HDAC6

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-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2023-04-13 US disclosed
EP-4013508-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES Bayer Aktiengesellschaft (DE) 2022-06-22 EP disclosed
CN-114466850-A [1,2,4] triazolo [1,5-C ] quinazolin-5-amines 拜耳股份有限公司 2022-05-10 CN disclosed
WO-2021028382-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2021-02-18 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-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES AHR, HRH4, HRH1 CA12 4840/4885CA14 4821/4885HDAC1 1491/4885

“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.