SCHEMBL30385270

SCHEMBL30385270

O=c1[nH]c(CC2CCC(c3ccc(-c4ccc(Nc5ccc(C(F)(F)F)nc5)nn4)cc3)CC2)no1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 8/20 0.53
▸ MEN1 O00255 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ABL1 P00519 1/20 0.35
▸ BCR P11274 1/20 0.35
▸ APP P05067 1/20 0.33
▸ SCD O00767 2/20 0.32

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
SCHEMBL16549571 1.00 DGAT1 (0.53) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL181096 1.00 DGAT1 (0.53) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL13664085 1.00 DGAT1 (0.53) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL14642922 1.00 DGAT1 (0.53) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL15445166 0.81 DGAT1 (0.54) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL180688 0.81 DGAT1 (0.54) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL13664084 0.81 DGAT1 (0.54) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL14617042 0.81 DGAT1 (0.54) DGAT1MEN1NPC1RAB9AKMT2A
SCHEMBL181168 0.81 DGAT1 (0.81) DGAT1
SCHEMBL181182 0.80 DGAT1 (0.68) DGAT1MEN1NPC1RAB9AKMT2A

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
CN-113166204-B Cyclic peptides as inhibitors of proprotein convertase subtilisin/kexin type 9 (PCSK 9) for the treatment of metabolic disorders 诺华股份有限公司 2025-01-28 — — CN disclosed
CN-113166114-B Cyclic tetramer compounds as inhibitors of proprotein convertase subtilisin/KEXIN type 9 (PCSK 9) for the treatment of metabolic disorders 诺华股份有限公司 2025-01-03 — — CN disclosed
WO-2023084449-A1 DIAMINOCYCLOPENTYLPYRIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE OR DISORDER NOVARTIS AG (CH) 2023-05-19 — — WO disclosed
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