SCHEMBL31037245

SCHEMBL31037245

CC(C)(C)OC(=O)NC1CCCN(CCNC(=O)c2ccc(C#Cc3cc(NC(=O)NCCc4cccnc4)ccc3-c3ccncc3)cc2)C1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 6/20 0.39
▸ CD274 Q9NZQ7 1/20 0.37
▸ NPY5R Q15761 3/20 0.37
▸ HIF1A Q16665 3/20 0.36
▸ EPAS1 Q99814 3/20 0.36
▸ CACNA1H O95180 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36

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
SCHEMBL31037313 0.97 NPY5R (0.40) NAMPTCD274NPY5RHIF1AEPAS1
SCHEMBL31037282 0.91 NAMPT (0.42) NAMPTHIF1AEPAS1
SCHEMBL31037278 0.89 NAMPT (0.40) NAMPTCD274NPY5RHIF1AEPAS1
SCHEMBL31037264 0.88 NAMPT (0.43) NAMPTHIF1AEPAS1
SCHEMBL31037270 0.87 NAMPT (0.36) NAMPTCD274NPY5RHIF1AEPAS1
SCHEMBL31037288 0.86 MAPK14 (0.42) NAMPTCD274HIF1AEPAS1
SCHEMBL31037260 0.86 NAMPT (0.43) NAMPTNPY5R
SCHEMBL31037343 0.85 NAMPT (0.53) NAMPTHIF1AEPAS1
SCHEMBL31037481 0.85 NAMPT (0.53) NAMPTHIF1AEPAS1
SCHEMBL31037295 0.85 NAMPT (0.42) NAMPTHIF1AEPAS1

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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