SCHEMBL8665945

SCHEMBL8665945

CCCCN(CC(F)(F)F)C(=O)C1c2ccccc2Sc2cccc(N3CCCC3NC(=O)OC(C)(C)C)c21

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 1/20 0.34
▸ CTSK P43235 1/20 0.31
▸ PIM1 P11309 1/20 0.30
▸ PIM3 Q86V86 1/20 0.30
▸ PIM2 Q9P1W9 1/20 0.30
▸ DRD2 P14416 3/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ DRD3 P35462 1/20 0.30

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
SCHEMBL8486150 0.98 PGR (0.32) PGRCTSKPIM1PIM3PIM2
SCHEMBL8663540 0.87 BRD4 (0.31) CTSKDRD2KMT2AL3MBTL1DRD3
SCHEMBL8662767 0.86 LMNA (0.37) PGRDRD2KMT2AL3MBTL1
SCHEMBL8479118 0.85 OPRK1 (0.32) CTSKDRD2KMT2AL3MBTL1DRD3
SCHEMBL8481555 0.84 LMNA (0.37) PGRDRD2KMT2AL3MBTL1
SCHEMBL8479790 0.79 OPRK1 (0.34) CTSKDRD2KMT2AL3MBTL1DRD3
SCHEMBL8483684 0.78 NPSR1 (0.41) DRD2KMT2ADRD3
SCHEMBL8666557 0.76 CCKBR (0.34) DRD2KMT2ADRD3
SCHEMBL8653114 0.76 CCR3 (0.42) DRD2KMT2AL3MBTL1DRD3
SCHEMBL8676079 0.74 CCKBR (0.35) —

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
US-5827875-A PYRROLIDINE DERIVATIVES; ANTIATHEROSCLEROSIS AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 1998-10-27 — — US disclosed
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