SCHEMBL29759757

SCHEMBL29759757

Cc1ncc(NC(=O)OC(C)(C)C)cc1NC(=O)c1cnn2cc(-c3cnn4c3OCCC4)sc12

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ POLQ O75417 2/20 0.39
▸ RORC P51449 2/20 0.38
▸ IRAK4 Q9NWZ3 1/20 0.36
▸ GPR6 P46095 2/20 0.33
▸ CCNT1 O60563 1/20 0.33
▸ CDK9 P50750 1/20 0.33
▸ PDGFRA P16234 2/20 0.31
▸ CHRM1 P11229 1/20 0.31
▸ HRH3 Q9Y5N1 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
SCHEMBL24579022 1.00 POLQ (0.39) POLQRORCIRAK4GPR6CCNT1
SCHEMBL24577573 0.89 POLQ (0.40) POLQIRAK4GPR6CCNT1CDK9
SCHEMBL24579021 0.87 POLQ (0.40) POLQIRAK4GPR6CCNT1CDK9
SCHEMBL29759526 0.86 POLQ (0.37) POLQIRAK4GPR6CCNT1CDK9
SCHEMBL27184973 0.86 POLQ (0.37) POLQIRAK4GPR6CCNT1CDK9
SCHEMBL24577845 0.86 POLQ (0.33) POLQIRAK4CCNT1CDK9
SCHEMBL24577397 0.86 POLQ (0.37) POLQIRAK4GPR6CCNT1CDK9
SCHEMBL29759540 0.85 POLQ (0.37) POLQIRAK4GPR6CCNT1CDK9
SCHEMBL29760033 0.85 POLQ (0.37) POLQIRAK4GPR6CCNT1CDK9
SCHEMBL24577376 0.85 POLQ (0.37) POLQIRAK4GPR6CCNT1CDK9

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 2 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
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