SCHEMBL24864576

SCHEMBL24864576

CC(=O)C(CNC(=O)CCCCCN1C(=O)C=CC1O)NC(=O)CCCCCN1C(=O)C=CC1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 7/20 0.39
▸ PTGS2 P35354 7/20 0.39
▸ SMN1; SMN2 Q16637 5/20 0.34
▸ MGLL Q99685 4/20 0.34
▸ ALDH1A1 P00352 4/20 0.34
▸ FAAH O00519 3/20 0.34
▸ HTT P42858 3/20 0.34
▸ MAPT P10636 3/20 0.34
▸ NPSR1 Q6W5P4 3/20 0.34
▸ HPGD P15428 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ PKM P14618 2/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ TLR9 Q9NR96 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ XBP1 P17861 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ GPR35 Q9HC97 1/20 0.34

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
SCHEMBL24864492 0.88 PTGS1 (0.49) PTGS1PTGS2SMN1; SMN2MGLLALDH1A1
SCHEMBL27292160 0.88 PTGS1 (0.49) PTGS1PTGS2SMN1; SMN2MGLLALDH1A1
SCHEMBL22044568 0.87 PTGS1 (0.36) PTGS1PTGS2SMN1; SMN2MGLLALDH1A1
SCHEMBL23583708 0.78 MEN1 (0.45) PTGS1PTGS2SMN1; SMN2ALDH1A1FAAH
SCHEMBL22238251 0.78 EPHX2 (0.35) PTGS1PTGS2SMN1; SMN2ALDH1A1FAAH
SCHEMBL21610368 0.76 MGLL (0.59) PTGS1PTGS2SMN1; SMN2MGLLALDH1A1
SCHEMBL19851854 0.76 MGLL (0.59) PTGS1PTGS2SMN1; SMN2MGLLALDH1A1
SCHEMBL22388826 0.76 NOD1 (0.39) SMN1; SMN2FAAHNPSR1LMNAMAPK1
SCHEMBL22223321 0.75 PTGS1 (0.61) PTGS1PTGS2SMN1; SMN2MGLLALDH1A1
SCHEMBL21727091 0.75 FAAH (0.43) PTGS1PTGS2SMN1; SMN2ALDH1A1FAAH

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
WO-2024151890-A1 LINKERS, DRUG LINKERS AND CONJUGATES THEREOF AND METHODS OF USING THE SAME PROFOUNDBIO US CO. (US) 2024-07-18 — — WO disclosed
WO-2023280227-A2 LINKERS, DRUG LINKERS AND CONJUGATES THEREOF AND METHODS OF USING THE SAME PROFOUNDBIO US CO. (US) 2023-01-12 — — WO disclosed
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