SCHEMBL23183524

SCHEMBL23183524

COCCOC(=O)c1cncc(CSc2[nH]c(=O)cc(-c3ccccc3)c2C#N)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.45
▸ POLB P06746 4/20 0.45
▸ MEN1 O00255 4/20 0.45
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ACMSD Q8TDX5 7/20 0.40
▸ ADORA1 P30542 3/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ SQOR Q9Y6N5 1/20 0.36
▸ TNF P01375 1/20 0.35
▸ PLA2G1B P04054 1/20 0.35
▸ NOD2 Q9HC29 1/20 0.35
▸ NOD1 Q9Y239 1/20 0.35
▸ ATG4B Q9Y4P1 1/20 0.35

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
SCHEMBL20339841 0.90 KMT2A (0.54) KMT2APOLBMEN1ALDH1A1HPGD
SCHEMBL31443033 0.86 ACMSD (0.51) KMT2APOLBMEN1ALDH1A1HPGD
SCHEMBL20340157 0.86 ACMSD (0.51) KMT2APOLBMEN1ALDH1A1HPGD
SCHEMBL23183542 0.79 ACMSD (0.57) KMT2APOLBMEN1ALDH1A1HPGD
SCHEMBL20339582 0.78 KMT2A (0.64) KMT2APOLBMEN1ALDH1A1HPGD
SCHEMBL20340172 0.75 ACMSD (0.61) KMT2APOLBMEN1ALDH1A1HPGD
SCHEMBL24087895 0.73 ACMSD (0.45) KMT2APOLBMEN1ALDH1A1HPGD
SCHEMBL32688306 0.73 KMT2A (0.59) KMT2APOLBMEN1ALDH1A1HPGD
SCHEMBL26847198 0.73 KMT2A (0.45) KMT2APOLBMEN1ALDH1A1HPGD
SCHEMBL20339813 0.72 ACMSD (0.55) KMT2APOLBMEN1ALDH1A1ACMSD

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-11780812-B2 Oxopyridine derivatives useful as aminocarboxymuconate semialdehyde decarboxylase (ACMSD) inhibitors ORSOBIO, INC. (US) 2023-10-10 — — US disclosed
US-20210094916-A1 OXOPYRIDINE DERIVATIVES USEFUL AS AMINOCARBOXYMUCONATE SEMIALDEHYDE DECARBOXYLASE (ACMSD) INHIBITORS ORSOBIO, INC. 2021-04-01 — — 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-20210094916-A1 OXOPYRIDINE DERIVATIVES USEFUL AS AMINOCARBOXYMUCONATE SEMIALDEHYDE DECARBOXYLASE (ACMSD) INHIBITORS ALDH7A1, OTC, DDC KMT2A 1374/4885POLB 757/4885MEN1 1839/4885
US-11780812-B2 Oxopyridine derivatives useful as aminocarboxymuconate semialdehyde decarboxylase (ACMSD) inhibitors ALDH7A1, ACMSD, AMD1 KMT2A 1309/4885POLB 906/4885MEN1 1478/4885

“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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