SCHEMBL19212401

SCHEMBL19212401

CC(C)(C)OC(=O)N1CCN(c2ncc(CCNC(=O)OCc3ccccc3)cc2Cl)CC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 5/20 0.54
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TLR9 Q9NR96 4/20 0.45
TLR7 Q9NYK1 2/20 0.45
ACHE P22303 1/20 0.45
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
KIT P10721 1/20 0.44
BACE1 P56817 1/20 0.43
SLC2A1 P11166 1/20 0.43
GPR119 Q8TDV5 1/20 0.42

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
SCHEMBL19212409 0.89 P2RY12 (0.57) P2RY12
SCHEMBL21457818 0.87 BACE1 (0.48) MEN1KMT2AACHEKEAP1NFE2L2
SCHEMBL28680929 0.85 P2RY12 (0.43) P2RY12KEAP1NFE2L2
SCHEMBL31142982 0.82 P2RY12 (0.61) P2RY12
SCHEMBL19211083 0.81 SMN1; SMN2 (0.52) MEN1KMT2AACHEBACE1SLC2A1
SCHEMBL24969726 0.79 P2RY12 (0.46) P2RY12MEN1KMT2ATLR9TLR7
SCHEMBL28683499 0.79 BACE1 (0.47) MEN1KMT2AACHEBACE1SLC2A1
SCHEMBL28688740 0.79 BACE1 (0.47) MEN1KMT2AACHEKEAP1NFE2L2
SCHEMBL19212337 0.79 MEN1 (0.51) P2RY12MEN1KMT2AKITGPR119
SCHEMBL31142973 0.78 P2RY12 (0.46) P2RY12MEN1KMT2AKITGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3414252-B1 THIENOPYRIDINE CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS VALO HEALTH INC (US) 2022-07-06 EP disclosed
CN-109071560-B Thienopyridine carboxamides as ubiquitin-specific protease inhibitors 瓦洛健康公司 2022-01-14 CN disclosed
EP-3414252-A1 THIENOPYRIDINE CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS Forma Therapeutics, Inc. (US) 2018-12-19 EP disclosed
WO-2017139778-A1 THIENOPYRIDINE CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS FORMA THERAPEUTICS, INC. (US) 2017-08-17 WO disclosed