SCHEMBL8662767

SCHEMBL8662767

CCCCN(CC(F)(F)F)C(=O)C1c2ccccc2Sc2cccc(N3CCCC3NC(=O)c3ccccc3Oc3ccccc3)c21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ CCR3 P51677 1/20 0.35
▸ TSHR P16473 3/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ HCRTR1 O43613 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ HTR1A P08908 1/20 0.32
▸ DRD2 P14416 1/20 0.32
▸ HTR7 P34969 1/20 0.32
▸ HTR6 P50406 1/20 0.32
▸ LPAR1 Q92633 1/20 0.31
▸ LPAR5 Q9H1C0 1/20 0.31
▸ OPRM1 P35372 1/20 0.31
▸ SIGMAR1 Q99720 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ KDM5A P29375 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
SCHEMBL8481555 0.98 LMNA (0.37) LMNAMAPTCCR3TSHRNPSR1
SCHEMBL8653114 0.88 CCR3 (0.42) LMNAMAPTCCR3TSHRNPSR1
SCHEMBL8482395 0.88 MAPT (0.38) LMNAMAPTCCR3TSHRNPSR1
SCHEMBL8665945 0.86 PGR (0.34) L3MBTL1PGRDRD2KMT2A
SCHEMBL8486150 0.84 PGR (0.32) PGRDRD2
SCHEMBL8485062 0.81 MAPT (0.40) LMNAMAPTCCR3TSHRNPSR1
SCHEMBL8668018 0.78 MAPT (0.39) LMNAMAPTCCR3TSHRNPSR1
SCHEMBL8717983 0.77 CCR3 (0.43) LMNAMAPTCCR3TSHRNPSR1
SCHEMBL8483684 0.77 NPSR1 (0.41) LMNAMAPTCCR3NPSR1DRD2
SCHEMBL8650737 0.77 POLB (0.32) LMNAALDH1A1KDM4E

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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