SCHEMBL6267486

SCHEMBL6267486

Cc1cc(COc2ccc(C(C)(CCC(C)Cl)C(=O)O)cc2)c2ccccc2n1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 10/20 0.51
MMP13 P45452 3/20 0.49
MMP2 P08253 1/20 0.49
ADAMTS4 O75173 1/20 0.49

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
SCHEMBL6264308 0.85 ADAM17 (0.56) ADAM17MMP13MMP2
SCHEMBL6267494 0.81 ADAM17 (0.51) ADAM17MMP13MMP2ADAMTS4
SCHEMBL6260459 0.79 ADAM17 (0.53) ADAM17MMP2ADAMTS4
SCHEMBL6266539 0.78 ADAM17 (0.57) ADAM17MMP2
SCHEMBL6261765 0.75 ADAM17 (0.47) ADAM17MMP13MMP2ADAMTS4
SCHEMBL4055405 0.74 ADAM17 (0.58) ADAM17MMP13MMP2
SCHEMBL3968177 0.74 ADAM17 (0.61) ADAM17MMP13MMP2ADAMTS4
SCHEMBL1504715 0.74 ADAM17 (0.64) ADAM17MMP13MMP2
SCHEMBL5887895 0.74 ADAM17 (0.61) ADAM17MMP13MMP2ADAMTS4
Hydrochloric Acid SCHEMBL4053797 0.74 ADAM17 (0.60) ADAM17MMP13MMP2ADAMTS4

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-2005085232-A1 HYDANTOIN DERIVATIVES FOR USE AS TACE AND AGGRECANASE INHIBITORS ASTRAZENECA AB (SE) 2005-09-15 WO disclosed