SCHEMBL7761860

SCHEMBL7761860

CCCNC(=O)[C@H](Cc1ccccc1)NC(=O)C1OC1C(=O)OCC

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 11/20 0.58
CTSL P07711 3/20 0.56
CTSB P07858 2/20 0.56
LMNA P02545 1/20 0.56
CTSG P08311 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.54
POLB P06746 1/20 0.51
MMP2 P08253 1/20 0.45

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
SCHEMBL7765662 0.93 CTSL (0.60) CAPN1CTSLCTSBLMNACTSG
SCHEMBL7762766 0.93 CTSL (0.60) CAPN1CTSLCTSBLMNACTSG
SCHEMBL7402596 0.91 CAPN1 (0.55) CAPN1CTSLCTSBLMNACTSG
SCHEMBL7765666 0.90 CAPN1 (0.59) CAPN1CTSLCTSBLMNACTSG
SCHEMBL9088881 0.90 CAPN1 (0.54) CAPN1CTSLCTSBLMNACTSG
SCHEMBL9229415 0.89 CHRNB2 (0.54) CAPN1CTSLCTSBLMNACTSG
SCHEMBL7407617 0.89 CAPN1 (0.52) CAPN1CTSLCTSBLMNACTSG
SCHEMBL9088720 0.89 CAPN1 (0.53) CAPN1CTSLCTSBLMNACTSG
SCHEMBL7406175 0.89 TSHR (0.57) CAPN1CTSLCTSBLMNACTSG
SCHEMBL7405238 0.89 CAPN1 (0.53) CAPN1CTSLCTSBLMNACTSG

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
EP-0808839-B1 EPOXYSUCCINAMIDE DERIVATIVES OR SALTS THEREOF, AND DRUGS CONTAINING THE SAME TAIHO PHARMACEUTICAL CO LTD (JP) 2001-05-23 EP disclosed
EP-0808839-A1 EPOXYSUCCINAMIDE DERIVATIVES OR SALTS THEREOF, AND DRUGS CONTAINING THE SAME TAIHO PHARMACEUTICAL CO., LTD. (JP) 1997-11-26 EP disclosed