SCHEMBL30690761

SCHEMBL30690761

Cc1ncc(NC(=O)CN2CCCC2C2CC2)cc1NC(=O)c1cnc2[nH]c(-c3cnn(C)c3)cc2c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIT P10721 11/20 0.41
CSF1R P07333 1/20 0.41
GSK3B P49841 6/20 0.40
DYRK1A Q13627 6/20 0.40
WNT1 P04628 5/20 0.40
CHRM1 P11229 1/20 0.37
PDGFRA P16234 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
ABL1 P00519 1/20 0.36
PIM1 P11309 1/20 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
SCHEMBL30690719 0.98 KIT (0.40) KITCSF1RGSK3BDYRK1AWNT1
SCHEMBL30690668 0.96 KIT (0.41) KITCSF1RGSK3BDYRK1AWNT1
SCHEMBL30690439 0.96 KIT (0.41) KITCSF1RGSK3BDYRK1AWNT1
SCHEMBL30690563 0.94 GSK3B (0.40) KITCSF1RGSK3BDYRK1AWNT1
SCHEMBL30690548 0.92 GSK3B (0.49) KITCSF1RGSK3BDYRK1AWNT1
SCHEMBL30690749 0.92 KIT (0.41) KITCSF1RGSK3BDYRK1AWNT1
SCHEMBL30690664 0.92 GSK3B (0.49) KITCSF1RGSK3BDYRK1AWNT1
SCHEMBL30690726 0.91 KIT (0.41) KITCSF1RGSK3BDYRK1AWNT1
SCHEMBL30690637 0.90 WNT1 (0.46) KITCSF1RGSK3BDYRK1AWNT1
SCHEMBL30690515 0.90 WNT1 (0.46) KITCSF1RGSK3BDYRK1AWNT1

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-2023247593-A1 PYRROLOPYRIDINE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2023-12-28 WO claimed