SCHEMBL7765736

SCHEMBL7765736

NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1O[C@@H]1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 5/20 0.52
HPGDS O60760 4/20 0.46
CTSB P07858 1/20 0.46
FPR3 P25089 1/20 0.45
FPR2 P25090 1/20 0.45
FCER2 P06734 2/20 0.44
MMP1 P03956 1/20 0.44
PPARG P37231 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
SCHEMBL6070071 1.00 CAPN1 (0.52) CAPN1HPGDSCTSBFPR3FPR2
SCHEMBL6070379 1.00 CAPN1 (0.52) CAPN1HPGDSCTSBFPR3FPR2
SCHEMBL7765729 1.00 CAPN1 (0.52) CAPN1HPGDSCTSBFPR3FPR2
SCHEMBL6070174 0.89 ACE (0.45) CAPN1
SCHEMBL7761900 0.84 CAPN1 (0.59) CAPN1CTSBFCER2MMP1
SCHEMBL7209524 0.84 CAPN1 (0.59) CAPN1FCER2MMP1
SCHEMBL7209529 0.84 CAPN1 (0.59) CAPN1FCER2MMP1
SCHEMBL7759040 0.83 CPB2 (0.46)
SCHEMBL7762727 0.83 FCER2 (0.56) CAPN1FCER2MMP1
SCHEMBL8344939 0.83 FCER2 (0.56) CAPN1FCER2MMP1

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