SCHEMBL1504887

SCHEMBL1504887

CS(=O)(=O)N1CCN([C@@H](CNC(=O)c2ccc3c(c2)CCO3)C(=O)O)CC1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 13/20 0.51
TAS1R3 Q7RTX0 3/20 0.47
TAS1R1 Q7RTX1 3/20 0.47
ADAM10 O14672 2/20 0.46
MMP3 P08254 2/20 0.46
ADAM9 Q13443 1/20 0.46
RAB9A P51151 1/20 0.45
MMP1 P03956 1/20 0.43

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
SCHEMBL10276701 0.92 ADAM17 (0.63) ADAM17TAS1R3TAS1R1ADAM10MMP3
SCHEMBL1504727 0.82 TAS1R3 (0.49) TAS1R3TAS1R1RAB9A
SCHEMBL10276416 0.80 ADAM17 (0.62) ADAM17ADAM10MMP3ADAM9RAB9A
SCHEMBL10276407 0.80 ADAM17 (0.62) ADAM17ADAM10MMP3ADAM9RAB9A
SCHEMBL1504806 0.77 ADAM17 (0.80) ADAM17ADAM10MMP3ADAM9MMP1
SCHEMBL1504889 0.74 ADAM17 (0.64) ADAM17ADAM10MMP3ADAM9MMP1
SCHEMBL1504606 0.72 ADAM17 (0.84) ADAM17ADAM10MMP3ADAM9MMP1
SCHEMBL1504608 0.72 ADAM17 (0.82) ADAM17ADAM10MMP3ADAM9MMP1
SCHEMBL13702300 0.72 TAS1R3 (0.66) TAS1R3TAS1R1RAB9A
SCHEMBL10276287 0.72 ADAM17 (0.83) ADAM17ADAM10MMP3ADAM9MMP1

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 5 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
WO-2011033009-A1 N- [2-HYDROXYCARBAMOYL-2- (PIPERAZINYL) ETHYL] BENZAMIDE COMPOUNDS, THEIR PREPARATION AND THEIR USE AS TACE INHIBITORS GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-03-24 WO 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 6/4885TAS1R3 1149/4885TAS1R1 739/4885

“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.