SCHEMBL19607355

SCHEMBL19607355

CC(C)(C)OC(=O)NCCN(C(=O)N1CCOCC1)C1CC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSL P07711 3/20 0.44
CTSB P07858 3/20 0.44
CTSD P07339 2/20 0.44
CTSS P25774 2/20 0.44
USP2 O75604 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
RECQL P46063 1/20 0.41
CTSK P43235 3/20 0.40
EPHX1 P07099 1/20 0.39
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.37
TSHR P16473 1/20 0.37
KMT2A Q03164 1/20 0.37
HTT P42858 2/20 0.36
GPR119 Q8TDV5 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL19607356 0.88 EPHX1 (0.46) CTSKEPHX1ALDH1A1MEN1TSHR
SCHEMBL19607358 0.85 CTSL (0.47) CTSLCTSBCTSDCTSSUSP2
SCHEMBL12524368 0.78 EPHX1 (0.40) CTSLCTSBCTSDCTSSEPHX1
SCHEMBL17028383 0.75 HTT (0.55) CTSLCTSBCTSDCTSSUSP2
SCHEMBL24951478 0.75 EPHX1 (0.44) CTSLCTSBCTSDCTSSEPHX1
SCHEMBL5619020 0.75 EPHX1 (0.44) EPHX1ALDH1A1MEN1TSHRKMT2A
SCHEMBL1328433 0.74 CTSD (0.54) CTSLCTSBCTSDCTSSUSP2
SCHEMBL20806059 0.72 TDP1 (0.46) EPHX1MEN1KMT2AHTT
SCHEMBL1495989 0.72 EPHX1 (0.49) EPHX1ALDH1A1MEN1TSHRKMT2A
SCHEMBL13055387 0.72 EPHX1 (0.53) CTSSCTSKEPHX1ALDH1A1MEN1

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-2017197324-A1 ADRENERGIC RECEPTOR MODULATING COMPOUNDS AND METHODS OF USING THE SAME THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2017-11-16 WO disclosed