SCHEMBL24577880

SCHEMBL24577880

COC(=O)c1cc(C)c(NC(=O)c2cnn3cc(-c4cnn(C)c4)sc23)s1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 1/20 0.36
▸ MAP3K5 Q99683 2/20 0.33
▸ KDM1A O60341 1/20 0.33
▸ IKBKE Q14164 1/20 0.33
▸ TBK1 Q9UHD2 1/20 0.33
▸ IRAK4 Q9NWZ3 3/20 0.33
▸ JAK2 O60674 3/20 0.32
▸ JAK1 P23458 2/20 0.32
▸ MARK3 P27448 3/20 0.32
▸ KAT5 Q92993 1/20 0.32
▸ PDK2 Q15119 1/20 0.32
▸ TYK2 P29597 1/20 0.32
▸ JAK3 P52333 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ GAA P10253 2/20 0.32
▸ STING1 Q86WV6 1/20 0.32
▸ CYP3A4 P08684 1/20 0.31
▸ HCRTR2 O43614 1/20 0.31
▸ HPGD P15428 1/20 0.31

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
SCHEMBL24577081 0.92 HDAC6 (0.37) HDAC6KDM1AIKBKETBK1IRAK4
SCHEMBL24578933 0.89 HDAC6 (0.35) HDAC6IKBKETBK1IRAK4JAK2
SCHEMBL24578969 0.87 RET (0.36) HDAC6ALDH1A1
SCHEMBL24577161 0.87 HDAC6 (0.39) HDAC6MAP3K5KDM1AIKBKETBK1
SCHEMBL24577029 0.85 HDAC6 (0.37) HDAC6MAP3K5KDM1AIKBKETBK1
SCHEMBL24577246 0.84 KIT (0.40) MARK3KDM4EALDH1A1HPGD
SCHEMBL24577253 0.84 ACKR3 (0.39) JAK2JAK1MARK3TYK2JAK3
SCHEMBL24577728 0.83 JAK2 (0.35) IRAK4JAK2JAK1TYK2JAK3
SCHEMBL24577862 0.82 MARK3 (0.36) HDAC6KDM1AIRAK4JAK2JAK1
SCHEMBL24578458 0.81 HDAC6 (0.36) HDAC6IKBKETBK1IRAK4JAK2

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 4 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
CN-116802184-A Pyrazolothiazole carboxamides and their use as PDGFR inhibitors 埃科特莱茵药品有限公司 2023-09-22 — — CN 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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