SCHEMBL24578944

SCHEMBL24578944

Cc1ncc(C(=O)NCCN2CC(C)(C)C2)cc1NC(=O)c1cnn2cc(-c3cnn4c3COCC4)sc12

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 2/20 0.43
▸ CHRM1 P11229 1/20 0.43
▸ HRH3 Q9Y5N1 1/20 0.43
▸ IRAK4 Q9NWZ3 6/20 0.33
▸ MAPK14 Q16539 1/20 0.33
▸ KIT P10721 1/20 0.32
▸ CCNT1 O60563 1/20 0.32
▸ CDK9 P50750 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ PSMD14 O00487 1/20 0.32
▸ STAMBP O95630 1/20 0.32
▸ CD274 Q9NZQ7 2/20 0.32

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
SCHEMBL29759978 1.00 PDGFRA (0.43) PDGFRACHRM1HRH3IRAK4MAPK14
SCHEMBL24576994 0.91 PDGFRA (0.45) PDGFRACHRM1HRH3IRAK4KIT
SCHEMBL29759492 0.91 PDGFRA (0.45) PDGFRACHRM1HRH3IRAK4KIT
SCHEMBL24577438 0.89 PDGFRA (0.57) PDGFRACHRM1HRH3IRAK4CCNT1
SCHEMBL29759862 0.89 PDGFRA (0.57) PDGFRACHRM1HRH3IRAK4CCNT1
SCHEMBL24577495 0.88 PDGFRA (0.46) PDGFRACHRM1HRH3IRAK4MAPK14
SCHEMBL29759545 0.88 PDGFRA (0.46) PDGFRACHRM1HRH3IRAK4MAPK14
SCHEMBL29759446 0.88 PDGFRA (0.49) PDGFRACHRM1HRH3IRAK4KIT
SCHEMBL24578084 0.88 PDGFRA (0.49) PDGFRACHRM1HRH3IRAK4KIT
SCHEMBL30809578 0.88 PDGFRA (0.49) PDGFRACHRM1HRH3IRAK4KIT

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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