SCHEMBL7319823

SCHEMBL7319823

COC(=O)c1c(Cc2cccnc2)c(C)c(N)c(-c2cccs2)c1S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 8/20 0.43
MMP9 P14780 5/20 0.41
MMP13 P45452 5/20 0.41
MMP1 P03956 4/20 0.41
ADAM17 P78536 2/20 0.41
CISD2 Q8N5K1 1/20 0.37
ALDH1A1 P00352 3/20 0.37
LMNA P02545 1/20 0.37
GLA P06280 1/20 0.37
HPGD P15428 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL7321883 0.94 NAMPT (0.43) NAMPTMMP9MMP13MMP1ADAM17
SCHEMBL7317088 0.93 NAMPT (0.42) NAMPTMMP9MMP13MMP1ADAM17
SCHEMBL7317860 0.92 MMP13 (0.46) NAMPTMMP9MMP13MMP1ADAM17
SCHEMBL7319594 0.87 NAMPT (0.42) NAMPTMMP9MMP13MMP1ADAM17
SCHEMBL7324058 0.87 NAMPT (0.49) NAMPTMMP9MMP13MMP1ADAM17
SCHEMBL7316608 0.84 MMP13 (0.47) NAMPTMMP9MMP13MMP1ADAM17
Hydrochloric Acid SCHEMBL7322736 0.84 MMP13 (0.46) NAMPTMMP9MMP13MMP1ADAM17
SCHEMBL7320893 0.83 NAMPT (0.46) NAMPTMMP9MMP13MMP1ADAM17
SCHEMBL7322608 0.82 NAMPT (0.42) NAMPTMMP9MMP13MMP1ADAM17
SCHEMBL7319557 0.81 NAMPT (0.42) NAMPTMMP9MMP13MMP1ADAM17

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
US-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed