SCHEMBL30690716

SCHEMBL30690716

Cc1ncc(NC(=O)CN2CC[C@@H]3CC[C@@H]3C2)cc1NC(=O)c1cnc2[nH]c(-c3cnn(C)c3)cc2c1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 14/20 0.45
DYRK1A Q13627 14/20 0.45
KIT P10721 5/20 0.41
CSF1R P07333 1/20 0.41
WNT1 P04628 13/20 0.40
ABL1 P00519 1/20 0.36

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
SCHEMBL30690501 1.00 GSK3B (0.45) GSK3BDYRK1AKITCSF1RWNT1
SCHEMBL30690666 0.96 KIT (0.42) GSK3BDYRK1AKITCSF1RWNT1
SCHEMBL30690608 0.95 GSK3B (0.43) GSK3BDYRK1AKITCSF1RWNT1
SCHEMBL30690660 0.93 KIT (0.42) GSK3BDYRK1AKITCSF1RWNT1
SCHEMBL30690513 0.93 KIT (0.42) GSK3BDYRK1AKITCSF1RWNT1
SCHEMBL30690448 0.93 GSK3B (0.43) GSK3BDYRK1AKITCSF1RWNT1
SCHEMBL30690740 0.93 GSK3B (0.43) GSK3BDYRK1AKITCSF1RWNT1
SCHEMBL30690643 0.92 GSK3B (0.47) GSK3BDYRK1AKITCSF1RWNT1
SCHEMBL30690591 0.91 GSK3B (0.47) GSK3BDYRK1AKITCSF1RWNT1
SCHEMBL30690728 0.90 GSK3B (0.43) GSK3BDYRK1AKITCSF1RWNT1

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