SCHEMBL19278217

SCHEMBL19278217

CS(=O)(=O)n1c(I)cc2c(Br)cnc(Cl)c21

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.35
▸ ABL1 P00519 1/20 0.35
▸ BCR P11274 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ HTT P42858 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL31279720 0.80 ALDH1A1 (0.37) ALDH1A1ABL1BCRLMNAHTT
SCHEMBL19252020 0.80 ALDH1A1 (0.37) ALDH1A1ABL1BCRLMNAHTT
SCHEMBL19268782 0.74 ALDH1A1 (0.34) ALDH1A1
SCHEMBL19278216 0.71 ABL1 (0.36) ALDH1A1ABL1BCRLMNAHTT
SCHEMBL19273979 0.70 METAP2 (0.31) —
SCHEMBL16340138 0.66 ABL1 (0.36) ALDH1A1ABL1BCRLMNAHTT
SCHEMBL28391967 0.66 ABL1 (0.40) ALDH1A1ABL1BCRLMNAHTT
SCHEMBL20536259 0.63 ABL1 (0.42) ALDH1A1ABL1BCRLMNAHTT
SCHEMBL25320029 0.62 PDE2A (0.33) ALDH1A1LMNA
SCHEMBL13579554 0.61 — —

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-2017143291-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION PMV PHARMACEUTICALS, INC. (US) 2017-08-24 — — WO disclosed
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