SCHEMBL29539746

SCHEMBL29539746

O=C(O)c1cc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2)c2ccccc2c1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 20/20 1.00
BCL2L1 Q07817 8/20 1.00

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
SCHEMBL18392406 1.00 MCL1 (1.00) MCL1BCL2L1
SCHEMBL18392310 0.86 MCL1 (0.85) MCL1BCL2L1
SCHEMBL30076624 0.86 MCL1 (0.85) MCL1BCL2L1
SCHEMBL29540152 0.84 MCL1 (1.00) MCL1BCL2L1
SCHEMBL18392259 0.84 MCL1 (1.00) MCL1BCL2L1
SCHEMBL29540209 0.83 MCL1 (1.00) MCL1BCL2L1
SCHEMBL29539751 0.83 MCL1 (1.00) MCL1BCL2L1
SCHEMBL29539977 0.83 MCL1 (1.00) MCL1BCL2L1
SCHEMBL18392262 0.83 MCL1 (1.00) MCL1BCL2L1
SCHEMBL18392238 0.83 MCL1 (1.00) MCL1BCL2L1

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-20220396549-A1 SMALL MOLECULE INHIBITORS OF THE MCL-1 ONCOPROTEIN AND USES THEROF UNIV MARYLAND (US) 2022-12-15 US disclosed
EP-3319938-B1 SMALL MOLECULE INHIBITORS OF THE MCL-1 ONCOPROTEIN AND USES THEREOF UNIV MARYLAND (US) 2022-04-06 EP 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-20220396549-A1 SMALL MOLECULE INHIBITORS OF THE MCL-1 ONCOPROTEIN AND USES THEROF MCL1, TP53, MYC MCL1 1/4885BCL2L1 4/4885

“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.