SCHEMBL29688331

SCHEMBL29688331

Cc1nnc(N2CCN(C(=O)c3ccc([C@@]4(C(C)C)NC(=O)NC4=O)cc3)CC2)c(C)c1C

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 2/20 0.37
SMO Q99835 3/20 0.36
ADAMTS5 Q9UNA0 6/20 0.35
ADAM17 P78536 4/20 0.35
MMP2 P08253 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MMP9 P14780 2/20 0.35
ALDH1A1 P00352 2/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
MGLL Q99685 1/20 0.34
MMP8 P22894 1/20 0.34
MMP13 P45452 1/20 0.34
SLC6A7 Q99884 1/20 0.33
LMNA P02545 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
SCHEMBL20135449 1.00 CRBN (0.37) CRBNSMOADAMTS5ADAM17MMP2
SCHEMBL20135450 1.00 CRBN (0.37) CRBNSMOADAMTS5ADAM17MMP2
SCHEMBL20135547 0.84 KDM4E (0.37) CRBNADAMTS5ADAM17MMP2MEN1
SCHEMBL20134817 0.84 ALDH1A1 (0.37) CRBNADAMTS5ADAM17MMP2MEN1
SCHEMBL29689068 0.84 KDM4E (0.37) CRBNADAMTS5ADAM17MMP2MEN1
SCHEMBL29688621 0.84 ALDH1A1 (0.37) CRBNADAMTS5ADAM17MMP2MEN1
SCHEMBL20135628 0.83 ADAMTS5 (0.42) CRBNADAMTS5ADAM17MMP2MMP13
SCHEMBL20135626 0.83 ADAMTS5 (0.42) CRBNADAMTS5ADAM17MMP2MMP13
SCHEMBL29689188 0.83 ADAMTS5 (0.42) CRBNADAMTS5ADAM17MMP2MMP13
SCHEMBL20134860 0.82 SLC6A7 (0.43) ADAMTS5ADAM17MEN1KMT2ASLC6A7

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