SCHEMBL31738150

SCHEMBL31738150

COC(=O)c1cccc(N2CCCN2C(=O)CNC(=O)NCc2ccc(N)cc2)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PPID Q08752 11/20 0.52
▸ PPIB P23284 9/20 0.47
▸ PPIG Q13427 7/20 0.47
▸ PPIA P62937 1/20 0.43
▸ TP53 P04637 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MAPT P10636 1/20 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
SCHEMBL31737952 0.96 PPID (0.48) PPIDPPIBPPIGPPIATP53
SCHEMBL31737668 0.89 PPID (0.55) PPIDPPIBPPIGPPIAGAA
SCHEMBL31737679 0.88 PPID (0.48) PPIDPPIBPPIGPPIAKMT2A
SCHEMBL31738345 0.87 PPID (0.46) PPIDPPIBPPIGPPIAGAA
SCHEMBL31737987 0.86 PPID (0.46) PPIDPPIBPPIGPPIAGAA
SCHEMBL31738191 0.85 PPID (0.48) PPIDPPIBPPIGPPIAGAA
SCHEMBL31738230 0.85 PPID (0.45) PPIDPPIBPPIGPPIASMN1; SMN2
SCHEMBL31738347 0.85 PPID (0.61) PPIDPPIBPPIGPPIASMN1; SMN2
SCHEMBL31738073 0.85 PPID (0.48) PPIDPPIBPPIGSMN1; SMN2MAPT
SCHEMBL31737680 0.84 PPID (0.49) PPIDPPIBPPIGPPIASMN1; 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
WO-2025243042-A1 COMPOUNDS FOR THE INHIBITION OF CYCLOPHILIN D THE UNIVERSITY OF LIVERPOOL (GB) 2025-11-27 — — WO claimed
WO-2025243042-A1 COMPOUNDS FOR THE INHIBITION OF CYCLOPHILIN D THE UNIVERSITY OF LIVERPOOL (GB) 2025-11-27 — — WO disclosed
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