SCHEMBL24577967

SCHEMBL24577967

Cc1ncc(NC(=O)CN2CCOCC2(C)C)cc1NC(=O)c1cnn2cc(-c3cnn(C)c3)sc12

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 2/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ HRH3 Q9Y5N1 1/20 0.42
▸ CSF1R P07333 1/20 0.37
▸ KIT P10721 1/20 0.37
▸ WNT1 P04628 6/20 0.36
▸ GSK3B P49841 6/20 0.36
▸ DYRK1A Q13627 6/20 0.36
▸ GRM2 Q14416 1/20 0.36
▸ RAF1 P04049 3/20 0.35
▸ BRAF P15056 3/20 0.35
▸ IRAK4 Q9NWZ3 5/20 0.34
▸ WNT3A P56704 2/20 0.33

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
SCHEMBL29759734 1.00 PDGFRA (0.42) PDGFRACHRM1HRH3CSF1RKIT
SCHEMBL29759819 0.93 PDGFRA (0.41) PDGFRACHRM1HRH3CSF1RKIT
SCHEMBL24577633 0.93 PDGFRA (0.41) PDGFRACHRM1HRH3CSF1RKIT
SCHEMBL29759966 0.92 PDGFRA (0.41) PDGFRACHRM1HRH3CSF1RKIT
SCHEMBL29759590 0.91 PDGFRA (0.47) PDGFRACHRM1HRH3CSF1RKIT
SCHEMBL29759450 0.90 PDGFRA (0.53) PDGFRACHRM1HRH3CSF1RKIT
SCHEMBL24577058 0.89 GSK3B (0.45) PDGFRACHRM1HRH3CSF1RKIT
SCHEMBL29759842 0.89 GSK3B (0.45) PDGFRACHRM1HRH3CSF1RKIT
SCHEMBL24577586 0.86 PDGFRA (0.45) PDGFRACHRM1HRH3CSF1RKIT
SCHEMBL29759502 0.86 PDGFRA (0.45) PDGFRACHRM1HRH3CSF1RKIT

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-2022136509-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2022-06-30 — — WO disclosed
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