SCHEMBL29689296

SCHEMBL29689296

Cc1cnc(C2CCN(C(=O)c3ccc([C@@]4(C(C)C)NC(=O)NC4=O)cc3)CC2)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK7 Q13164 8/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ADAMTS5 Q9UNA0 3/20 0.38
ADAM17 P78536 1/20 0.38
EGLN1 Q9GZT9 1/20 0.35
CRBN Q96SW2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
PDE2A O00408 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL20135536 1.00 MAPK7 (0.39) MAPK7MEN1KMT2AADAMTS5ADAM17
SCHEMBL20135321 0.87 MAPK7 (0.43) MAPK7MEN1KMT2AADAMTS5ADAM17
SCHEMBL29689074 0.87 MAPK7 (0.43) MAPK7MEN1KMT2AADAMTS5ADAM17
SCHEMBL20135263 0.87 PAK1 (0.46) MEN1KMT2ACRBN
SCHEMBL20135260 0.87 PAK1 (0.46) MEN1KMT2ACRBN
SCHEMBL20134879 0.85 CCNK (0.44)
SCHEMBL20134945 0.85 CCNK (0.44)
SCHEMBL20135485 0.85 CCNK (0.44)
SCHEMBL20134883 0.85 CCNK (0.44)
SCHEMBL29689349 0.85 KMT2A (0.37) MAPK7MEN1KMT2AADAMTS5ADAM17

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
CN-107922347-B Novel imide derivatives and their use as pharmaceuticals 田边三菱制药株式会社 2022-06-28 CN disclosed