SCHEMBL6741404

SCHEMBL6741404

CC(C)CC(CO)NC(=O)[C@H]1O[C@@H]1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 12/20 0.58
CTSB P07858 3/20 0.58
CAPN9 O14815 2/20 0.58
MAPK1 P28482 2/20 0.58
CTSK P43235 3/20 0.51
CTSL P07711 3/20 0.48
LMNA P02545 2/20 0.48
CTSH P09668 1/20 0.48
CTSS P25774 1/20 0.48
CTSC P53634 1/20 0.48
CYP3A4 P08684 1/20 0.48
TSHR P16473 1/20 0.48
CYP2C19 P33261 1/20 0.48
USP2 O75604 1/20 0.48
MAPT P10636 1/20 0.48
BLM P54132 1/20 0.48
CTSG P08311 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
SCHEMBL6741406 1.00 CAPN1 (0.58) CAPN1CTSBCAPN9MAPK1CTSK
SCHEMBL7206790 0.82 CTSK (0.76) CAPN1CTSBCAPN9MAPK1CTSK
SCHEMBL913603 0.82 CTSK (0.76) CAPN1CTSBCAPN9MAPK1CTSK
SCHEMBL6735420 0.82 CTSK (0.76) CAPN1CTSBCAPN9MAPK1CTSK
SCHEMBL7615476 0.81 CAPN1 (0.58) CAPN1CTSBCAPN9MAPK1CTSK
SCHEMBL2730672 0.81 CTSK (0.74) CAPN1CTSBCAPN9MAPK1CTSK
SCHEMBL913547 0.81 CTSK (0.74) CAPN1CTSBCAPN9MAPK1CTSK
SCHEMBL11063045 0.79 CAPN1 (0.68) CAPN1CTSBCAPN9MAPK1CTSK
SCHEMBL6735494 0.79 CTSK (0.53) CAPN1CTSBCAPN9MAPK1CTSK
SCHEMBL6742229 0.79 CTSK (0.60) CAPN1CTSBCAPN9MAPK1CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6689785-B2 USEFUL PARTICULARLY AS REMEDIES FOR BONE DISEASES AND ARTHRITIS NIPPON CHEMIPHAR CO., LTD. (JP) 2004-02-10 US disclosed
EP-1342720-A2 Epoxysuccinamide derivatives NIPPON CHEMIPHAR CO., LTD. (JP) 2003-09-10 EP disclosed
EP-1022276-B1 EPOXYSUCCINAMIDE DERIVATIVES NIPPON CHEMIPHAR CO (JP) 2003-05-28 EP disclosed
US-20020091131-A1 Epoxysuccinamide derivatives VELCURA THERAPEUTICS, INC. 2002-07-11 US disclosed
US-6387908-B1 BONE DISORDERS; ANTIARTHRITIC AGENTS NIPPON CHEMIPHAR CO., LTD. (JP) 2002-05-14 US disclosed
EP-1022276-A1 EPOXYSUCCINAMIDE DERIVATIVES NIPPON CHEMIPHAR CO., LTD. (JP) 2000-07-26 EP 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-20020091131-A1 Epoxysuccinamide derivatives NR0B1, NR2E1, NR4A1 CAPN1 3204/4885CTSB 3812/4885CAPN9 2914/4885

“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.