SCHEMBL21020405

SCHEMBL21020405

COc1ccc(CN2C=C(c3cc(C(C)=O)nc(S(C)(=O)=O)n3)C=CC2O)cc1OC

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 3/20 0.41
▸ KMT2A Q03164 4/20 0.35
▸ SMN1; SMN2 Q16637 4/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ MEN1 O00255 3/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ ATM Q13315 1/20 0.33
▸ SIGMAR1 Q99720 1/20 0.32
▸ RAD52 P43351 1/20 0.32
▸ KDM4E B2RXH2 3/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ GLA P06280 1/20 0.32
▸ STAT1 P42224 1/20 0.32

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
SCHEMBL23897448 0.91 SDHB (0.40) SDHBKMT2ASMN1; SMN2LMNATP53
SCHEMBL21019829 0.84 SDHB (0.40) SDHBKMT2ASMN1; SMN2LMNATP53
SCHEMBL21020109 0.84 SDHB (0.40) SDHBKMT2ASMN1; SMN2LMNATP53
SCHEMBL21019734 0.74 SDHB (0.56) SDHBKMT2ASMN1; SMN2LMNATP53
SCHEMBL21019517 0.74 SDHB (0.54) SDHBKMT2ASMN1; SMN2LMNATP53
SCHEMBL19805646 0.74 SDHB (0.71) SDHB
SCHEMBL29976514 0.74 SDHB (0.71) SDHB
SCHEMBL21020592 0.73 SDHB (0.49) SDHBKMT2ASMN1; SMN2LMNATP53
SCHEMBL28306297 0.73 ACHE (0.39) SDHBKMT2ASMN1; SMN2HPGDMEN1
SCHEMBL21019460 0.73 SDHB (0.50) SDHBKMT2ASMN1; SMN2LMNATP53

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-11034680-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-06-15 — — US disclosed
US-20190152960-A1 Apoptosis Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2019-05-23 — — 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-20190152960-A1 Apoptosis Inhibitors BAX, SDHA, SDHB SDHB 3/4885KMT2A 3060/4885SMN1; SMN2 1698/4885
US-11034680-B2 Apoptosis inhibitors BAX, SDHA, SDHB SDHB 3/4885KMT2A 3060/4885SMN1; SMN2 1698/4885

“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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