SCHEMBL5655902

SCHEMBL5655902

NC(=O)[C@H](CCC(=O)O)N(Cc1cccc(I)c1)C(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 2/20 0.43
TRPM8 Q7Z2W7 3/20 0.42
MMP2 P08253 2/20 0.40
MMP8 P22894 1/20 0.40
MMP13 P45452 1/20 0.40
FOLH1 Q04609 2/20 0.38
MDM2 Q00987 1/20 0.38
PTGES O14684 3/20 0.38
ALOX5 P09917 3/20 0.38
HSD17B1 P14061 1/20 0.38
HSD17B2 P37059 1/20 0.38
HPGDS O60760 1/20 0.37
AOC3 Q16853 3/20 0.37
LTC4S Q16873 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
SCHEMBL2246723 0.88 MMP12 (0.44) MMP12TRPM8MMP2MMP8MMP13
SCHEMBL4361259 0.84 TRPM8 (0.53) MMP12TRPM8MDM2HPGDSAOC3
SCHEMBL4370875 0.84 MMP12 (0.41) MMP12TRPM8MMP2MMP8MMP13
SCHEMBL4362591 0.84 HPGDS (0.49) MMP12TRPM8MMP2MMP8MMP13
SCHEMBL5650478 0.84 TRPM8 (0.50) MMP12TRPM8MMP2MMP8MMP13
SCHEMBL2246642 0.83 MMP12 (0.41) MMP12MMP2MMP8MMP13PTGES
SCHEMBL27826145 0.82 TRPM8 (0.46) TRPM8FOLH1
SCHEMBL4369489 0.82 PTGES (0.45) MMP12MMP2MMP8MMP13PTGES
SCHEMBL2247349 0.81 HSD17B2 (0.45) MMP12TRPM8PTGESHSD17B1HSD17B2
SCHEMBL2244759 0.81 HSD17B2 (0.45) MMP12TRPM8HSD17B1HSD17B2AOC3

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-20070043066-A1 Glutamate aggrecanase inhibitors WYETH (US) 2007-02-22 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-20070043066-A1 Glutamate aggrecanase inhibitors ADAMTS5, ADAMTS1, ADAMTS7 MMP12 54/4885TRPM8 1187/4885MMP2 49/4885

“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.