SCHEMBL31037254

SCHEMBL31037254

O=C(NCCc1cccnc1)Nc1ccc(N2CCNCC2)c(C#Cc2ccc(F)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 11/20 0.46
▸ LMNA P02545 1/20 0.42
▸ ALK Q9UM73 1/20 0.41
▸ PRMT3 O60678 1/20 0.41
▸ NPC1 O15118 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ HIF1A Q16665 2/20 0.38
▸ EPAS1 Q99814 2/20 0.38

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
SCHEMBL31037336 0.88 NAMPT (0.42) NAMPTLMNAALKPRMT3MAPT
SCHEMBL31037335 0.86 KEAP1 (0.44) NAMPTLMNAALKPRMT3
SCHEMBL31037262 0.84 MAPT (0.41) NAMPTLMNAALKMAPT
SCHEMBL31037286 0.82 LMNA (0.48) NAMPTLMNAPRMT3NPC1MAPT
SCHEMBL31037293 0.82 LMNA (0.48) NAMPTLMNAPRMT3NPC1MAPT
SCHEMBL31037302 0.80 NAMPT (0.51) NAMPTLMNAPRMT3NPC1MAPT
SCHEMBL31037301 0.80 NAMPT (0.50) NAMPTLMNAPRMT3NPC1MAPT
SCHEMBL31037328 0.79 NAMPT (0.46) NAMPTLMNAPRMT3RAB9ASMN1; SMN2
SCHEMBL31037483 0.79 NAMPT (0.47) NAMPTLMNAPRMT3HIF1AEPAS1
SCHEMBL31037498 0.79 LMNA (0.44) NAMPTLMNAPRMT3RAB9ASMN1; 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
EP-4663628-A1 NEW COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Samjin Pharmaceutical Co., Ltd. (KR) 2025-12-17 — — EP disclosed
WO-2024166024-A1 NEW COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 삼진제약주식회사 2024-08-15 — — WO disclosed
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