SCHEMBL24578458

SCHEMBL24578458

CCc1cc(C(=O)O)sc1NC(=O)c1cnn2cc(-c3cnn(C)c3)sc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 1/20 0.36
▸ MARK3 P27448 5/20 0.35
▸ IKBKE Q14164 1/20 0.35
▸ TBK1 Q9UHD2 1/20 0.35
▸ LRRK2 Q5S007 1/20 0.34
▸ STING1 Q86WV6 1/20 0.33
▸ MET P08581 4/20 0.32
▸ JAK1 P23458 3/20 0.32
▸ JAK3 P52333 3/20 0.32
▸ IRAK4 Q9NWZ3 3/20 0.32
▸ KIT P10721 2/20 0.32
▸ SGK1 O00141 1/20 0.32
▸ PIK3CD O00329 1/20 0.32
▸ CHEK1 O14757 1/20 0.32
▸ MAPK13 O15264 1/20 0.32
▸ PDPK1 O15530 1/20 0.32
▸ NUAK1 O60285 1/20 0.32
▸ CCNT1 O60563 1/20 0.32
▸ JAK2 O60674 1/20 0.32
▸ ROCK2 O75116 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
SCHEMBL24578933 0.93 HDAC6 (0.35) HDAC6MARK3IKBKETBK1LRRK2
SCHEMBL24577081 0.89 HDAC6 (0.37) HDAC6MARK3IKBKETBK1LRRK2
SCHEMBL24578460 0.87 HDAC6 (0.36) HDAC6MARK3IKBKETBK1LRRK2
SCHEMBL29760178 0.83 RAB9A (0.34) IRAK4MAPK1MAPK14
SCHEMBL24577707 0.82 PDGFRA (0.42) MARK3
SCHEMBL24577880 0.81 HDAC6 (0.36) HDAC6MARK3IKBKETBK1STING1
SCHEMBL24577161 0.79 HDAC6 (0.39) HDAC6MARK3IKBKETBK1JAK1
SCHEMBL24578969 0.78 RET (0.36) HDAC6
SCHEMBL24577338 0.78 HDAC6 (0.39) HDAC6STING1KITCHEK1PIM1
SCHEMBL24577029 0.77 HDAC6 (0.37) HDAC6MARK3IKBKETBK1JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4267585-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS Actelion Pharmaceuticals Ltd (CH) 2023-11-01 — — EP disclosed
WO-2022136509-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2022-06-30 — — WO disclosed
WO-2022136509-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2022-06-30 — — WO disclosed
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