SCHEMBL29688652

SCHEMBL29688652

CCC1(c2ccc(C)c(F)c2)NC(=O)NC1=O

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP14 P50281 6/20 0.54
MMP8 P22894 5/20 0.54
MMP17 Q9ULZ9 4/20 0.41
MMP2 P08253 3/20 0.41
MMP1 P03956 1/20 0.41
ADAM17 P78536 3/20 0.40
ADAMTS5 Q9UNA0 2/20 0.39
MMP13 P45452 1/20 0.36
MMP3 P08254 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
SCHEMBL20134812 1.00 MMP14 (0.54) MMP14MMP8MMP17MMP2MMP1
SCHEMBL20134755 0.90 MMP14 (0.53) MMP14MMP8MMP17MMP2MMP1
SCHEMBL20134964 0.85 MMP14 (0.51) MMP14MMP8MMP17MMP2MMP1
SCHEMBL20135060 0.81 MMP14 (0.45) MMP14MMP8MMP17MMP2MMP1
SCHEMBL20135269 0.79 MMP14 (0.43) MMP14MMP8MMP17MMP2MMP1
SCHEMBL29688624 0.79 MMP14 (0.43) MMP14MMP8MMP17MMP2MMP1
SCHEMBL542441 0.79 MMP14 (0.46) MMP14MMP8MMP17MMP2MMP1
SCHEMBL3410690 0.78 ADAM17 (0.60) MMP14MMP8MMP17MMP2MMP1
SCHEMBL20135652 0.78 ADAM17 (0.60) MMP14MMP8MMP17MMP2MMP1
SCHEMBL20135513 0.78 ADAM17 (0.60) MMP14MMP8MMP17MMP2MMP1

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