SCHEMBL3087168

SCHEMBL3087168

CCN(Cc1cccc(-c2ccc(S(=O)(=O)NC(C)(C)c3cnn[nH]3)cc2)c1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 3/20 0.39
LIMK1 P53667 2/20 0.39
LIMK2 P53671 2/20 0.39
PTGES O14684 1/20 0.39
AOC3 Q16853 2/20 0.38
NMT1 P30419 6/20 0.37
LMNA P02545 2/20 0.36
HPGD P15428 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
KCNA5 P22460 1/20 0.36
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
HTT P42858 1/20 0.35
ROCK2 O75116 1/20 0.35

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
SCHEMBL3077608 0.95 PTGES (0.42) ADAMTS4LIMK1LIMK2PTGESNMT1
SCHEMBL3086081 0.89 ROCK2 (0.40) ADAMTS4LIMK1LIMK2PTGESNMT1
SCHEMBL3097439 0.89 ADAMTS4 (0.40) ADAMTS4PTGESNMT1HSD17B1HSD17B2
SCHEMBL3071908 0.88 ADAMTS4 (0.43) ADAMTS4PTGESNMT1HSD17B1HSD17B2
SCHEMBL3084477 0.84 MMP1 (0.39) ADAMTS4PTGESNMT1HSD17B1HSD17B2
SCHEMBL4793214 0.84 NAMPT (0.41) ADAMTS4AOC3NMT1ALDH1A1HSD17B1
SCHEMBL4795906 0.82 NMT1 (0.48) ADAMTS4NMT1
SCHEMBL3082269 0.82 NMT1 (0.46) ADAMTS4NMT1
Hydrochloric Acid SCHEMBL3097044 0.81 NMT1 (0.48) ADAMTS4NMT1
SCHEMBL4793217 0.81 JAK2 (0.38) ADAMTS4MAPTHSD17B1HSD17B2HTT

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
US-20100234378-A1 ALKYLSULFONAMIDE-SUBSTITUTED TRIAZOLES AS MATRIX METALLOPROTEASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2010-09-16 US claimed
US-20100234378-A1 ALKYLSULFONAMIDE-SUBSTITUTED TRIAZOLES AS MATRIX METALLOPROTEASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2010-09-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100234378-A1 ALKYLSULFONAMIDE-SUBSTITUTED TRIAZOLES AS MATRIX METALLOPROTEASE INHIBITORS MMP3, MMP11, MMP13 ADAMTS4 31/4885LIMK1 4802/4885LIMK2 4358/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.