SCHEMBL7752664

SCHEMBL7752664

CCOC(=O)[C@H](CNC(=O)OC(C)(C)C)NS(=O)(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.47
MAPT P10636 2/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ATM Q13315 1/20 0.44
BACE1 P56817 1/20 0.43
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 3/20 0.42
TSHR P16473 2/20 0.42
ITGAV P06756 2/20 0.42
PSMB8 P28062 1/20 0.41
MMP2 P08253 2/20 0.41
MMP9 P14780 2/20 0.41
ITGB3 P05106 3/20 0.41
ITGA2B P08514 3/20 0.41
BCL2 P10415 1/20 0.41
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
CTSL P07711 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
SCHEMBL7752387 0.91 MMP2 (0.44) SYKMAPTHTTSMN1; SMN2HSD17B10
SCHEMBL7400842 0.91 SYK (0.46) SYKMAPTHSD17B10KMT2AALDH1A1
SCHEMBL7400840 0.91 SYK (0.46) SYKMAPTHSD17B10KMT2AALDH1A1
SCHEMBL27464973 0.88 ITGAV (0.53) MAPTALDH1A1ITGAVMMP2MMP9
SCHEMBL7041551 0.88 ITGAV (0.53) MAPTALDH1A1ITGAVMMP2MMP9
SCHEMBL7753608 0.88 ALDH1A1 (0.49) HTTSMN1; SMN2HSD17B10ALDH1A1MMP2
SCHEMBL7748751 0.87 SYK (0.42) SYKMAPTALDH1A1TSHRITGAV
SCHEMBL7753610 0.85 ITGAV (0.57) SYKITGAVCTSS
SCHEMBL7752653 0.82 CA1 (0.45) SYKSMN1; SMN2KMT2AALDH1A1ITGAV
SCHEMBL7754751 0.82 MMP2 (0.42) MAPTHTTSMN1; SMN2HSD17B10BACE1

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
EP-0725059-B1 2,3-DIAMINOPROPIONIC ACID DERIVATIVE SUMITOMO PHARMA (JP) 2001-01-17 EP disclosed
US-6048854-A ANTICOAGULANTS; ANTICANCER AGENT; WOUND HEALING AGENTS;BONE DISORDERS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2000-04-11 US disclosed
US-5707994-A USEFUL AS A PLATELET AGGREGATION INHIBITOR, CANCER METASTASIS INHIBITOR, WOUND HEALING AGENT OR A BONE RESORPTION INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-01-13 US disclosed
EP-0725059-A1 2,3-DIAMINOPROPIONIC ACID DERIVATIVE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1996-08-07 EP disclosed