SCHEMBL6350415

SCHEMBL6350415

Cc1cc(COc2ccc([C@]3(N)CCN(C(CC(C)C)C(=O)NO)C3=O)cc2)c2ccccc2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 15/20 1.00
MMP3 P08254 7/20 1.00
MMP2 P08253 7/20 1.00
MMP9 P14780 7/20 1.00
MMP1 P03956 6/20 1.00
MMP7 P09237 4/20 1.00
MMP8 P22894 4/20 1.00
MMP13 P45452 4/20 1.00
MMP14 P50281 4/20 1.00
ADAM10 O14672 4/20 1.00
ADAM33 Q9BZ11 2/20 0.68
MMP15 P51511 1/20 0.68
MMP16 P51512 1/20 0.68

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
SCHEMBL29732231 1.00 ADAM17 (1.00) ADAM17MMP3MMP2MMP9MMP1
SCHEMBL6350418 1.00 ADAM17 (1.00) ADAM17MMP3MMP2MMP9MMP1
SCHEMBL1021287 1.00 ADAM17 (1.00) ADAM17MMP3MMP2MMP9MMP1
SCHEMBL6681213 0.93 ADAM17 (0.86) ADAM17MMP3MMP2MMP9MMP1
SCHEMBL6681788 0.91 ADAM17 (0.84) ADAM17MMP3MMP2MMP9MMP1
SCHEMBL6685255 0.91 ADAM17 (0.84) ADAM17MMP3MMP2MMP9MMP1
SCHEMBL4193352 0.90 ADAM17 (1.00) ADAM17MMP3MMP2MMP9MMP1
SCHEMBL8282217 0.90 ADAM17 (1.00) ADAM17MMP3MMP2MMP9MMP1
SCHEMBL8354979 0.90 ADAM17 (0.82) ADAM17MMP3MMP2MMP9MMP1
SCHEMBL4207403 0.90 ADAM17 (0.82) ADAM17MMP3MMP2MMP9MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240156867-A1 ENGINEERED IMMUNE CELL THERAPEUTICS AND METHODS OF USE Catamaran Bio, Inc. 2024-05-16 US disclosed
US-20050261762-A1 Medical devices to prevent or inhibit restenosis MEDTRONIC VASCULAR, INC. (US) 2005-11-24 US disclosed
WO-2004060212-A1 ANTI-INFLAMMATORY COATING FOR IMPLANTABLE MEDICAL DEVICES BRISTOL-MYERS SQUIBB COMPANY (US) 2004-07-22 WO disclosed