SCHEMBL8433741

SCHEMBL8433741

CC(=O)OC(c1noc(Cc2ccccc2)n1)[C@@H](NC(=O)OCc1ccccc1)C(C)C

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 16/20 0.52
PRSS2 P07478 16/20 0.52
PRSS3 P35030 16/20 0.52
TPSAB1 Q15661 16/20 0.52
ATM Q13315 1/20 0.44

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
SCHEMBL8436756 0.94 PRSS1 (0.57) PRSS1PRSS2PRSS3TPSAB1ATM
SCHEMBL8433174 0.91 PRSS1 (0.44) PRSS1PRSS2PRSS3TPSAB1ATM
SCHEMBL8434777 0.91 PRSS1 (0.49) PRSS1PRSS2PRSS3TPSAB1ATM
SCHEMBL8433316 0.90 PRSS1 (0.45) PRSS1PRSS2PRSS3TPSAB1ATM
SCHEMBL8435688 0.90 PRSS1 (0.43) PRSS1PRSS2PRSS3TPSAB1ATM
SCHEMBL8435264 0.90 PRSS1 (0.43) PRSS1PRSS2PRSS3TPSAB1ATM
SCHEMBL8434771 0.89 PRSS1 (0.49) PRSS1PRSS2PRSS3TPSAB1ATM
SCHEMBL8433073 0.88 ATM (0.46) PRSS1PRSS2PRSS3TPSAB1ATM
SCHEMBL8434716 0.87 PRSS1 (0.56) PRSS1PRSS2PRSS3TPSAB1ATM
SCHEMBL8432904 0.86 ATM (0.44) PRSS1PRSS2PRSS3TPSAB1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5874585-A TREATMENT AND/OR PREVENTION OF ELASTASE-MEDIATED PROBLEMS SUCH AS ARTHRITIS, PERIODONTAL DISEASE, GLOMERULONEPHRITIS, DERMATITIS, PSORIASIS, CYSTIC FIBROSIS, CHRONIC BRONCHITIS, ALZHEIMER'S DISEASE CORTECH, INC. (US) 1999-02-23 US disclosed