SCHEMBL10425835

SCHEMBL10425835

Cc1cscc1N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.35
▸ CTSL P07711 1/20 0.31
▸ CTSB P07858 1/20 0.31
▸ CTSS P25774 1/20 0.31
▸ CPB2 Q96IY4 2/20 0.31
▸ ITGB2 P05107 1/20 0.31
▸ ICAM1 P05362 1/20 0.31
▸ ITGAL P20701 1/20 0.31
▸ CPB1 P15086 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL10426034 1.00 MAPT (0.35) MAPTCTSLCTSBCTSSCPB2
SCHEMBL4519604 0.78 MME (0.36) —
SCHEMBL7357707 0.77 PPARG (0.36) MAPTSMN1; SMN2
SCHEMBL1073717 0.77 ITGB2 (0.36) CPB2ITGB2ICAM1ITGALCPB1
SCHEMBL163396 0.77 CPB2 (0.36) CPB2ITGB2ICAM1ITGALCPB1
SCHEMBL27547178 0.77 CPB2 (0.36) CPB2ITGB2ICAM1ITGALCPB1
SCHEMBL151335 0.77 CPB2 (0.36) CPB2ITGB2ICAM1ITGALCPB1
SCHEMBL151334 0.77 CPB2 (0.36) CPB2ITGB2ICAM1ITGALCPB1
SCHEMBL5542778 0.77 CPB2 (0.33) CPB2ITGB2ICAM1ITGALCPB1
SCHEMBL5542771 0.77 CPB2 (0.33) CPB2ITGB2ICAM1ITGALCPB1

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-4898878-A Antioxidant thiohistidine compounds THE BOARD OF REGENTS OF THE UNIVERSITY OF WASHINGTON (US) 1990-02-06 — — US disclosed
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