SCHEMBL10275940

SCHEMBL10275940

COCCOCOc1ccc(C(=O)NC[C@@H](C(=O)O)N2CCN(S(=O)(=O)C(C)C)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 18/20 0.55
MMP3 P08254 3/20 0.48
ADAM10 O14672 2/20 0.48
ADAM9 Q13443 1/20 0.48
MMP1 P03956 2/20 0.45
HRH2 P25021 1/20 0.42
HRH1 P35367 1/20 0.42
TP53 P04637 1/20 0.40

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
SCHEMBL10275951 1.00 ADAM17 (0.55) ADAM17MMP3ADAM10ADAM9MMP1
SCHEMBL1504822 0.93 ADAM17 (0.51) ADAM17MMP3ADAM10ADAM9MMP1
SCHEMBL10276770 0.91 ADAM17 (0.62) ADAM17MMP3ADAM10ADAM9MMP1
SCHEMBL10276145 0.91 ADAM17 (0.62) ADAM17MMP3ADAM10ADAM9MMP1
SCHEMBL10275947 0.87 ADAM17 (0.49) ADAM17MMP3ADAM10ADAM9MMP1
SCHEMBL10475882 0.85 ADAM17 (0.55) ADAM17MMP3ADAM10MMP1TP53
SCHEMBL10475842 0.85 ADAM17 (0.55) ADAM17MMP3ADAM10MMP1TP53
SCHEMBL10275880 0.84 ADAM17 (0.44) ADAM17MMP3ADAM10ADAM9MMP1
SCHEMBL10275887 0.84 ADAM17 (0.44) ADAM17MMP3ADAM10ADAM9MMP1
SCHEMBL10475892 0.84 ADAM17 (0.53) ADAM17TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9115102-B2 N-[2-hydroxycarbamoyl-2-(piperazinyl) ethyl] benzamide compounds, their preparation and their use as TACE inhibitors GALDERMA RESEARCH & DEVELOPMENT (FR) 2015-08-25 US disclosed
EP-2477968-B1 N-[2-HYDROXYCARBAMOYL-2-(PIPERAZINYL)ETHYL]BENZAMIDE COMPOUNDS, THEIR PREPARATION AND THEIR USE AS TACE INHIBITORS GALDERMA RES & DEV (FR) 2013-10-23 EP disclosed
EP-2477968-A1 N- [2-HYDROXYCARBAMOYL-2- (PIPERAZINYL) ETHYL]BENZAMIDE COMPOUNDS, THEIR PREPARATION AND THEIR USE AS TACE INHIBITORS Galderma Research & Development (FR) 2012-07-25 EP disclosed
US-20120178934-A1 N- [2-HYDROXYCARBAMOYL-2- (PIPERAZINYL) ETHYL] BENZAMIDE COMPOUNDS, THEIR PREPARATION AND THEIR USE AS TACE INHIBITORS GALDERMA RESEARCH & DEVELOPMENT (FR) 2012-07-12 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-20120178934-A1 N- [2-HYDROXYCARBAMOYL-2- (PIPERAZINYL) ETHYL] BENZAMIDE COMPOUNDS, THEIR PREPARATION AND THEIR USE AS TACE INHIBITORS CTSB, TPSAB1, PIGS ADAM17 6/4885MMP3 265/4885ADAM10 20/4885

“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.