SCHEMBL30809503

SCHEMBL30809503

Cc1ncc(C(=O)NCCN2CCC3(CCO3)CC2)cc1NC(=O)c1cnn2cc(-c3cnn4c3CCC4)sc12

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 2/20 0.43
▸ CHRM1 P11229 1/20 0.43
▸ HRH3 Q9Y5N1 1/20 0.43
▸ IRAK4 Q9NWZ3 5/20 0.35
▸ KIT P10721 1/20 0.34
▸ POLQ O75417 1/20 0.34
▸ MAPK14 Q16539 1/20 0.31
▸ STAT3 P40763 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
SCHEMBL30809490 0.91 PDGFRA (0.44) PDGFRACHRM1HRH3KITPOLQ
SCHEMBL30809539 0.91 PDGFRA (0.45) PDGFRACHRM1HRH3IRAK4KIT
SCHEMBL30809543 0.90 PDGFRA (0.44) PDGFRACHRM1HRH3KITPOLQ
SCHEMBL24576994 0.89 PDGFRA (0.45) PDGFRACHRM1HRH3IRAK4KIT
SCHEMBL29759492 0.89 PDGFRA (0.45) PDGFRACHRM1HRH3IRAK4KIT
SCHEMBL30809522 0.88 PDGFRA (0.45) PDGFRACHRM1HRH3IRAK4KIT
SCHEMBL30809550 0.87 PDGFRA (0.42) PDGFRACHRM1HRH3KITPOLQ
SCHEMBL30809496 0.87 PDGFRA (0.42) PDGFRACHRM1HRH3KITPOLQ
SCHEMBL24577506 0.86 PDGFRA (0.59) PDGFRACHRM1HRH3IRAK4KIT
SCHEMBL24577581 0.86 PDGFRA (0.51) PDGFRACHRM1HRH3KITPOLQ

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-2023247596-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2023-12-28 — — WO claimed
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