SCHEMBL26627417

SCHEMBL26627417

COC(=O)C1CCS(=O)(=O)N1.COC(=O)C1CCS(=O)(=O)N1Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.50
MMP9 P14780 4/20 0.50
MMP13 P45452 4/20 0.50
CAPN1 P07384 1/20 0.48
MMP1 P03956 2/20 0.47
ADAM17 P78536 1/20 0.41
FKBP1A P62942 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.39
GYS1 P13807 7/20 0.39
P2RX7 Q99572 1/20 0.39

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
SCHEMBL1765109 0.89 MMP2 (0.60) MMP2MMP9MMP13CAPN1MMP1
SCHEMBL30603052 0.83 MMP2 (0.48) MMP2MMP9MMP13CAPN1MMP1
SCHEMBL12555619 0.77 MMP2 (0.46) MMP2MMP9MMP13CAPN1MMP1
SCHEMBL1612206 0.76 MMP2 (0.56) MMP2MMP9MMP13CAPN1MMP1
SCHEMBL1611046 0.75 MMP2 (0.64) MMP2MMP9MMP13CAPN1MMP1
SCHEMBL1764763 0.74 MMP2 (0.46) MMP2MMP9MMP13CAPN1MMP1
SCHEMBL19401473 0.73 GYS1 (0.45) MMP2MMP9MMP13CAPN1MMP1
SCHEMBL1764679 0.73 GYS1 (0.45) MMP2MMP9MMP13CAPN1MMP1
SCHEMBL1764799 0.73 KMT2A (0.38)
SCHEMBL1765120 0.73 KMT2A (0.38)

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-2023209090-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AND THEIR APPLICATION IN THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2023-11-02 WO disclosed