SCHEMBL24576986

SCHEMBL24576986

NC(=O)c1cnn2cc(-c3cnn4c3CCC4)sc12

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 1/20 0.37
▸ CYP11B1 P15538 7/20 0.36
▸ CYP11B2 P19099 7/20 0.36
▸ POLQ O75417 1/20 0.36
▸ KDM5B Q9UGL1 2/20 0.32
▸ CDK9 P50750 4/20 0.31
▸ PIK3CD O00329 1/20 0.30
▸ KIT P10721 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
SCHEMBL29760058 0.84 ACVR1 (0.33) CDK9
SCHEMBL29759980 0.81 POLQ (0.34) POLQCDK9
SCHEMBL24577500 0.75 POLQ (0.42) BACE1POLQCDK9KIT
SCHEMBL28975942 0.75 CYP11B2 (0.39) CYP11B1CYP11B2CDK9
SCHEMBL24579054 0.74 POLQ (0.44) BACE1POLQCDK9KIT
SCHEMBL30566551 0.73 MKNK1 (0.40) CYP11B2
SCHEMBL24577570 0.73 CCNT1 (0.36) CDK9
SCHEMBL25172258 0.71 HTR2A (0.43) CYP11B1CYP11B2POLQCDK9
SCHEMBL29759849 0.71 TYK2 (0.33) —
SCHEMBL24576870 0.70 MKNK1 (0.41) —

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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