SCHEMBL27275302

SCHEMBL27275302

Cc1cc2[nH]c(=O)c(=O)[nH]c2nc1S(=O)(=O)Nc1ccc(C(C)C)cc1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.50
▸ THRB P10828 2/20 0.50
▸ LMNA P02545 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ TP53 P04637 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ PKM P14618 3/20 0.43
▸ PGR P06401 1/20 0.42
▸ KIT P10721 1/20 0.42
▸ IDH1 O75874 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ MAP2K4 P45985 1/20 0.40

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
SCHEMBL27275411 0.83 BRD4 (0.52) MAPTTHRBLMNAMEN1KMT2A
SCHEMBL24876653 0.81 LMNA (0.69) MAPTTHRBLMNAMEN1KMT2A
SCHEMBL31680016 0.81 LMNA (0.69) MAPTTHRBLMNAMEN1KMT2A
SCHEMBL27275299 0.81 LMNA (0.49) MAPTTHRBLMNAMEN1KMT2A
SCHEMBL27275406 0.79 LMNA (0.46) MAPTTHRBLMNAMEN1KMT2A
SCHEMBL27275408 0.79 MAPT (0.52) MAPTTHRBMEN1KMT2ATP53
SCHEMBL27275409 0.77 MEN1 (0.41) MAPTTHRBLMNAMEN1KMT2A
SCHEMBL27275402 0.77 MEN1 (0.43) MAPTTHRBLMNAMEN1KMT2A
SCHEMBL27275211 0.76 LMNA (0.47) MAPTTHRBLMNAMEN1KMT2A
SCHEMBL27275617 0.75 MAPT (0.42) MAPTTHRBLMNAMEN1KMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024133220-A1 INHIBITORS OF α-HEMOLYSIN OF STAPHYLOCOCCUS AUREUS Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2024-06-27 — — WO disclosed
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