SCHEMBL31037495

SCHEMBL31037495

CC(C(=O)NC1CCCCC1)c1ccc(NC(=O)NCCc2cccnc2)cc1C#Cc1ccc(C(=O)NCCN2CCCCC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 8/20 0.43
▸ HIF1A Q16665 3/20 0.42
▸ EPAS1 Q99814 3/20 0.42
▸ ABL1 P00519 1/20 0.38
▸ BCR P11274 1/20 0.38
▸ CHRNA7 P36544 1/20 0.38
▸ C3AR1 Q16581 3/20 0.37
▸ ACKR3 P25106 1/20 0.37
▸ BMPR1B O00238 1/20 0.37
▸ BMPR1A P36894 1/20 0.37
▸ TGFBR1 P36897 1/20 0.37
▸ ACVRL1 P37023 1/20 0.37
▸ ACVR1 Q04771 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL31037481 0.81 NAMPT (0.53) NAMPTHIF1AEPAS1ABL1BCR
SCHEMBL31037343 0.81 NAMPT (0.53) NAMPTHIF1AEPAS1ABL1BCR
SCHEMBL31037338 0.81 HRH3 (0.41) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL31037344 0.81 NAMPT (0.50) NAMPTHIF1AEPAS1CHRNA7
SCHEMBL31037329 0.81 NAMPT (0.45) NAMPTHIF1AEPAS1ABL1BCR
SCHEMBL31037278 0.80 NAMPT (0.40) NAMPTHIF1AEPAS1ABL1BCR
SCHEMBL31037334 0.80 BMPR1B (0.46) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL31037282 0.78 NAMPT (0.42) NAMPTHIF1AEPAS1
SCHEMBL31037354 0.77 ALDH1A1 (0.42) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL31037264 0.76 NAMPT (0.43) NAMPTHIF1AEPAS1ABL1BCR

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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