SCHEMBL7404237

SCHEMBL7404237

Cc1cc(C(C)Oc2ccc(C(=O)NC(C)C3(C(=O)NO)CCCCC3)cc2)c2ccccc2n1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 5/20 0.47
SMN1; SMN2 Q16637 1/20 0.42
ADAM10 O14672 1/20 0.42
MMP1 P03956 1/20 0.42

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
SCHEMBL7407963 0.84 ADAM17 (0.48) ADAM17SMN1; SMN2ADAM10MMP1
SCHEMBL7404740 0.81 SMN1; SMN2 (0.50) ADAM17SMN1; SMN2ADAM10MMP1
SCHEMBL7400898 0.77 ADAM17 (0.67) ADAM17
SCHEMBL7403617 0.76 SMN1; SMN2 (0.44) ADAM17SMN1; SMN2
SCHEMBL6629887 0.76 SMN1; SMN2 (0.49) SMN1; SMN2
SCHEMBL7400907 0.75 SMN1; SMN2 (0.53) ADAM17SMN1; SMN2ADAM10MMP1
SCHEMBL7402599 0.75 ADAM17 (0.55) ADAM17SMN1; SMN2ADAM10MMP1
SCHEMBL7401098 0.74 ADAM17 (0.61) ADAM17
SCHEMBL7399912 0.74 ADAM17 (0.73) ADAM17
SCHEMBL6633286 0.74 SMN1; SMN2 (0.47) SMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1263756-A2 BETA-AMINO ACID DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEASES AND TNF-ALPHA Bristol-Myers Squibb Pharma Company (US) 2002-12-11 EP disclosed
WO-2001070734-A2 BETA-AMINO ACID DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEASES AND TNF-ALPHA BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-09-27 WO disclosed