SCHEMBL8665585

SCHEMBL8665585

CCCCN(CC(F)(F)F)C(=O)C1c2ccccc2-c2cccc(N3CCC(NS(=O)(=O)c4ccccc4)C3)c21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH2 P25021 1/20 0.35
▸ HRH1 P35367 1/20 0.35
▸ HTR7 P34969 9/20 0.34
▸ HTR1A P08908 8/20 0.34
▸ AKT1 P31749 1/20 0.34
▸ WNT3 P56703 2/20 0.34
▸ SFRP1 Q8N474 2/20 0.34
▸ CTSB P07858 3/20 0.34
▸ CTSK P43235 3/20 0.34
▸ UCHL1 P09936 2/20 0.34
▸ CTSS P25774 2/20 0.34
▸ CTSC P53634 2/20 0.34
▸ USP30 Q70CQ3 2/20 0.34
▸ CTSL P07711 1/20 0.34
▸ SMPD3 Q9NY59 1/20 0.34
▸ CCR3 P51677 1/20 0.33
▸ MTNR1A P48039 1/20 0.33
▸ MTNR1B P49286 1/20 0.33
▸ DRD2 P14416 3/20 0.33
▸ HTR6 P50406 3/20 0.33

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
SCHEMBL8712879 0.95 HTR1A (0.37) HTR7HTR1AWNT3SFRP1CCR3
SCHEMBL8665880 0.86 UTS2R (0.39) AKT1CTSBCTSKCTSLMTNR1A
SCHEMBL8664869 0.85 SMPD3 (0.38) SMPD3MTNR1AMTNR1B
SCHEMBL8666092 0.84 UTS2R (0.39) AKT1CTSBCTSKCTSLMTNR1A
SCHEMBL8485533 0.83 NPSR1 (0.42) CCR3DRD2
SCHEMBL8665515 0.82 CCR3 (0.41) HTR7HTR1ACCR3MTNR1AMTNR1B
SCHEMBL8713180 0.82 CKS1B (0.41) DRD2
SCHEMBL8501233 0.81 NPSR1 (0.36) DRD2
SCHEMBL8484454 0.81 NPSR1 (0.42) CCR3DRD2
SCHEMBL8593677 0.81 ALDH1A1 (0.36) HTR1ADRD2

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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