SCHEMBL30809509

SCHEMBL30809509

Cc1ncc(NC(=O)CN2CCCC2(C)C)cc1NC(=O)c1cnn2cc(-c3cccnc3F)sc12

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 3/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ HRH3 Q9Y5N1 1/20 0.42
▸ JAK2 O60674 4/20 0.31
▸ JAK1 P23458 3/20 0.31
▸ TYK2 P29597 1/20 0.31
▸ JAK3 P52333 1/20 0.31
▸ IRAK4 Q9NWZ3 8/20 0.31
▸ NTRK1 P04629 1/20 0.31
▸ CSF1R P07333 1/20 0.30
▸ KIT P10721 1/20 0.30
▸ ATR Q13535 1/20 0.30
▸ SPPL2A Q8TCT8 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
SCHEMBL24579030 0.91 CHRM1 (0.41) PDGFRACHRM1HRH3JAK2JAK1
SCHEMBL29759802 0.90 CHRM1 (0.40) PDGFRACHRM1HRH3JAK2JAK1
SCHEMBL24579076 0.90 CHRM1 (0.40) PDGFRACHRM1HRH3JAK2JAK1
SCHEMBL30809506 0.87 PDGFRA (0.44) PDGFRACHRM1HRH3JAK2JAK1
SCHEMBL30809569 0.87 PDGFRA (0.46) PDGFRACHRM1HRH3JAK2JAK1
SCHEMBL30809540 0.86 PDGFRA (0.42) PDGFRACHRM1HRH3JAK2NTRK1
SCHEMBL24577404 0.86 PDGFRA (0.45) PDGFRACHRM1HRH3JAK2JAK1
SCHEMBL29760148 0.86 PDGFRA (0.45) PDGFRACHRM1HRH3JAK2JAK1
SCHEMBL24577317 0.86 PDGFRA (0.41) PDGFRACHRM1HRH3CSF1RKIT
SCHEMBL29759450 0.85 PDGFRA (0.53) PDGFRACHRM1HRH3IRAK4CSF1R

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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