SCHEMBL29589716

SCHEMBL29589716

CC(=O)Nc1ccc(OC(=O)N2CCc3ccc(C(=O)N4Cc5ccccc5C[C@H]4C)cc3C2)cc1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 12/20 0.56
▸ RAB9A P51151 3/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ NPC1 O15118 2/20 0.46
▸ NAMPT P43490 4/20 0.46
▸ PRMT5 O14744 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
SCHEMBL29589794 0.89 BCL2 (0.57) BCL2
SCHEMBL29589933 0.87 BCL2 (0.54) BCL2
SCHEMBL29589838 0.85 HPGD (0.56) BCL2RAB9ASMN1; SMN2
SCHEMBL28825992 0.84 RAB9A (0.62) RAB9AMAPK1SMN1; SMN2NPC1NAMPT
SCHEMBL29589723 0.83 BCL2 (0.52) BCL2
SCHEMBL29590211 0.82 RAB9A (0.62) BCL2RAB9AMAPK1SMN1; SMN2NPC1
SCHEMBL29590813 0.82 BCL2 (0.55) BCL2
SCHEMBL29590139 0.81 NR1H2 (0.56) BCL2MAPK1NAMPTPRMT5
SCHEMBL29590466 0.79 HSP90AA1 (0.47) SMN1; SMN2NPC1NAMPTPRMT5
SCHEMBL29590775 0.79 HSP90AA1 (0.47) MAPK1SMN1; SMN2NPC1NAMPTPRMT5

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
CN-109456324-B Isoindoline or isoquinoline compounds, process for their preparation and pharmaceutical compositions containing them 法国施维雅药厂 2022-04-22 — — CN disclosed
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