SCHEMBL29132371

SCHEMBL29132371

CC(C)(C)OC(=O)N1CCC(CN2C[C@@H](CN3CCN(C(=O)OCc4ccccc4)CC3)CC2=O)CC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
HTT P42858 1/20 0.46
KDM4E B2RXH2 1/20 0.46
PKM P14618 1/20 0.46
CYP2C19 P33261 1/20 0.45
PARP1 P09874 1/20 0.45
YAP1 P46937 2/20 0.44
GRIN2B Q13224 6/20 0.44
CYP2D6 P10635 3/20 0.44
CYP2C9 P11712 3/20 0.44
CYP3A4 P08684 2/20 0.44
STS P08842 1/20 0.43
FPR2 P25090 1/20 0.43
GPR119 Q8TDV5 1/20 0.42
JAK2 O60674 1/20 0.42
JAK1 P23458 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
SCHEMBL29132038 1.00 SMN1; SMN2 (0.47) SMN1; SMN2NPC1RAB9AHTTKDM4E
SCHEMBL29132130 1.00 SMN1; SMN2 (0.47) SMN1; SMN2NPC1RAB9AHTTKDM4E
SCHEMBL29132404 0.94 SMN1; SMN2 (0.47) SMN1; SMN2NPC1RAB9AHTTKDM4E
SCHEMBL29132098 0.94 SMN1; SMN2 (0.47) SMN1; SMN2NPC1RAB9AHTTKDM4E
SCHEMBL29132096 0.94 SMN1; SMN2 (0.47) SMN1; SMN2NPC1RAB9AHTTKDM4E
SCHEMBL18921646 0.91 SMN1; SMN2 (0.56) SMN1; SMN2NPC1RAB9AHTTKDM4E
SCHEMBL2386800 0.91 SMN1; SMN2 (0.56) SMN1; SMN2NPC1RAB9AHTTKDM4E
SCHEMBL30179036 0.88 SMN1; SMN2 (0.53) SMN1; SMN2NPC1RAB9AHTTKDM4E
SCHEMBL30602886 0.88 SMN1; SMN2 (0.53) SMN1; SMN2NPC1RAB9AHTTKDM4E
SCHEMBL26705305 0.88 SMN1; SMN2 (0.53) SMN1; SMN2NPC1RAB9AHTTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4308557-A1 INDAZOLE BASED COMPOUNDS AND ASSOCIATED METHODS OF USE Arvinas Operations, Inc. (US) 2024-01-24 EP disclosed
CN-117321046-A Indazole-based compounds and related methods of use 阿维纳斯企业公司 2023-12-29 CN disclosed
WO-2022198112-A1 INDAZOLE BASED COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2022-09-22 WO disclosed