SCHEMBL7337481

SCHEMBL7337481

COC(OC(C)=O)(c1ccccc1)N1C(=O)c2c(C(C)C)cc3c(c2S1(=O)=O)CN(C)CO3

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.32
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL8865964 0.67 ELANE (0.62) ELANE
SCHEMBL7329263 0.67 ELANE (0.33) ELANE
SCHEMBL7330926 0.65 ELANE (0.40) ELANE
SCHEMBL10334579 0.52 ALDH1A1 (0.49) MAPT
SCHEMBL784813 0.52 CES1 (0.47) ELANEKDM4EMAPT
SCHEMBL22585992 0.51 HRH3 (0.46) KDM4EMAPT
SCHEMBL5537289 0.50 MAPT (0.53) KDM4EMAPT
SCHEMBL8324538 0.50 CYP2C19 (0.48) ELANEKDM4EMAPT
SCHEMBL5666953 0.49 KCNN4 (0.47) ELANEKDM4EMAPT
SCHEMBL1096837 0.49 KCNN4 (0.47) ELANEKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5489604-A TREATING DEGENERATIVE DISEASES STERLING WINTHROP, INC. (US) 1996-02-06 US disclosed
US-5385923-A Treatment of degenerative diseases STERLING WINTHROP INC. (US) 1995-01-31 US disclosed
EP-0550112-A1 2-Saccharinylmethyl aryl and aryloxy acetates useful as proteolytic enzyme inhibitors and pharmaceutical compositions contaning them STERLING WINTHROP INC. (US) 1993-07-07 EP disclosed