SCHEMBL24945384

SCHEMBL24945384

Cc1cccc(-n2ccnc2SCC(=O)Nc2ccccc2C(F)(F)F)c1

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.73
▸ MAPT P10636 2/20 0.71
▸ TP53 P04637 9/20 0.66
▸ NPC1 O15118 1/20 0.64
▸ GAA P10253 1/20 0.64
▸ RAB9A P51151 1/20 0.64
▸ SMN1; SMN2 Q16637 3/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ POLB P06746 1/20 0.61
▸ USP2 O75604 1/20 0.60

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
SCHEMBL24945385 0.84 MAPT (0.66) LMNAMAPTTP53NPC1GAA
SCHEMBL26687687 0.79 TP53 (0.70) LMNAMAPTTP53NPC1GAA
SCHEMBL13236226 0.75 TP53 (1.00) LMNAMAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL24943938 0.74 TP53 (1.00) LMNAMAPTTP53ALDH1A1
SCHEMBL24045328 0.74 TP53 (0.71) MAPTTP53
SCHEMBL24943939 0.73 TP53 (0.81) LMNAMAPTTP53ALDH1A1POLB
SCHEMBL24045258 0.72 MAPT (0.89) LMNAMAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL4215617 0.71 PTGES (0.62) LMNAMAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL24045100 0.70 MAPK1 (0.75) MAPTTP53POLB
SCHEMBL24045321 0.69 MAPT (0.89) LMNAMAPTTP53SMN1; SMN2ALDH1A1

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-2023009347-A1 COMPOUNDS FOR MODULATING EPITHELIAL 15-(S)-LIPOXYGENASE-2 AND METHODS OF USE FOR SAME THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-02-02 — — WO disclosed
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