SCHEMBL30052834

SCHEMBL30052834

COC(=O)c1ccc([C@H]2C[C@H](O)CCN2C(=O)OCc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.47
TMEM97 Q5BJF2 6/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PDE4B Q07343 1/20 0.43
KDM1A O60341 1/20 0.43
RCOR1 Q9UKL0 1/20 0.43

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
SCHEMBL24179625 1.00 SIGMAR1 (0.47) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL30053112 1.00 SIGMAR1 (0.47) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL29148961 1.00 SIGMAR1 (0.47) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL28540053 1.00 SIGMAR1 (0.47) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL28529378 1.00 SIGMAR1 (0.47) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL16409317 0.89 SIGMAR1 (0.46) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL29148988 0.89 SIGMAR1 (0.46) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL29148979 0.89 SIGMAR1 (0.46) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL29213769 0.89 SIGMAR1 (0.46) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2
SCHEMBL17782309 0.89 SIGMAR1 (0.46) SIGMAR1TMEM97NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120081822-A Substituted indole compounds and methods of use thereof 诺瓦提斯药物公司 2025-06-03 CN disclosed
CN-117500499-A Substituted indole compounds and methods of use thereof 奇努克治疗公司 2024-02-02 CN disclosed