SCHEMBL5315792

SCHEMBL5315792

Cc1ccc(CCC(CO)NC(=O)OC(C)(C)C)cc1C

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.42
AAK1 Q2M2I8 1/20 0.42
CTSS P25774 2/20 0.41
CTSK P43235 2/20 0.41
SYK P43405 1/20 0.40
PPARA Q07869 3/20 0.38
PPARG P37231 2/20 0.38

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
SCHEMBL5312595 0.85
SCHEMBL16978180 0.84 TSHR (0.44) ATMAAK1CTSSCTSKPPARA
SCHEMBL6308451 0.83 MMP1 (0.42)
SCHEMBL1759778 0.82 CTSK (0.50) ATMAAK1CTSSCTSKPPARA
SCHEMBL21409069 0.82 CTSK (0.50) ATMAAK1CTSSCTSKSYK
SCHEMBL31751716 0.82 PPARG (0.48) ATMAAK1CTSSCTSKPPARA
SCHEMBL21409066 0.82 CTSK (0.50) ATMAAK1CTSSCTSKSYK
SCHEMBL3842588 0.82 CTSK (0.59) ATMCTSSCTSKSYKPPARA
SCHEMBL7696221 0.82 CTSK (0.59) ATMCTSSCTSKSYKPPARA
SCHEMBL14338698 0.82 CTSK (0.59) ATMCTSSCTSKSYKPPARA

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
WO-2007047575-A2 PHARMACOLOGICAL TREATMENTS FOR SLEEP-RELATED BREATHING DISORDERS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-04-26 WO disclosed