SCHEMBL27287482

SCHEMBL27287482

CC(=O)[C@H](Cc1cccc(C)c1)NC=O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CTSB P07858 10/20 0.45
▸ POLB P06746 1/20 0.45
▸ CTSL P07711 5/20 0.44
▸ CTSS P25774 4/20 0.44
▸ CTSK P43235 2/20 0.42
▸ CTSV O60911 1/20 0.41
▸ TACR1 P25103 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ TAAR1 Q96RJ0 1/20 0.41
▸ MAPT P10636 1/20 0.40

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
SCHEMBL15179166 0.83 CTSB (0.48) CTSBPOLBCTSLCTSSCTSK
SCHEMBL13827709 0.83 MEN1 (0.59) POLBCTSSCTSKALDH1A1MEN1
SCHEMBL19042806 0.83 MEN1 (0.59) POLBCTSSCTSKALDH1A1MEN1
SCHEMBL26178948 0.76 MME (0.57) CTSBPOLBCTSLCTSSCTSK
SCHEMBL4725412 0.76 MDM2 (0.50) CTSBPOLBCTSLCTSSALDH1A1
SCHEMBL27270915 0.76 MME (0.50) MEN1KMT2ATAAR1
SCHEMBL14432427 0.76 POLB (0.53) CTSBPOLBCTSLCTSSCTSK
SCHEMBL13154997 0.75 FDPS (0.47) KDM4EKMT2A
SCHEMBL12524788 0.75 ESR1 (0.51) KDM4EMEN1KMT2ATAAR1
SCHEMBL9828630 0.75 TACR1 (0.58) CTSBPOLBCTSLCTSSCTSK

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024059472-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2024-03-21 — — WO disclosed
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