SCHEMBL7434161

SCHEMBL7434161

CC(C)(C)OCc1ccc(CNC(=O)C(O)C(CC(F)(F)F)N(C=O)OC(C)(C)C)cc1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 2/20 0.32
PLG P00747 1/20 0.32
PRSS1 P07477 1/20 0.32
EPHX2 P34913 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
SCHEMBL7429900 0.89 KMT2A (0.39) EPHX2
SCHEMBL7445420 0.88 EPHX2 (0.38) EPHX2
SCHEMBL7431992 0.85 L3MBTL1 (0.44)
SCHEMBL7441218 0.81 ALDH1A1 (0.45)
SCHEMBL7437324 0.81 CTSK (0.33) EPHX2
SCHEMBL7437313 0.81 CTSK (0.33) EPHX2
SCHEMBL7438937 0.79 OPRM1 (0.43)
SCHEMBL7438045 0.77
SCHEMBL7438232 0.77
SCHEMBL7445784 0.77

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-6187905-B1 PEPTIDE COMPOUND WHICH INHIBITS VIRAL PROTEINASES; VIRICIDES FOR HEPATITIS C, HEPATITIS G, AND HUMAN GB VIRUSES HOFFMANN-LA ROCHE INC. 2001-02-13 US disclosed