SCHEMBL8668018

SCHEMBL8668018

CCCCN(CC(F)(F)F)C(=O)C1c2ccccc2-c2cccc(N3CCC(NC(=O)c4ccccc4Oc4ccccc4)C3=O)c21

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ CCR3 P51677 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ FPR2 P25090 8/20 0.34
▸ FPR1 P21462 7/20 0.34
▸ SCN1A P35498 1/20 0.33
▸ SCN2A Q99250 1/20 0.33
▸ SCN3A Q9NY46 1/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ HTR7 P34969 1/20 0.33
▸ HTR6 P50406 1/20 0.33
▸ TSHR P16473 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ HTT P42858 1/20 0.31

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
SCHEMBL8665488 0.90 CCR2 (0.37) FPR2FPR1HTR1A
SCHEMBL8717983 0.87 CCR3 (0.43) MAPTLMNACCR3NPSR1L3MBTL1
SCHEMBL8482395 0.87 MAPT (0.38) MAPTLMNACCR3NPSR1L3MBTL1
SCHEMBL8665515 0.86 CCR3 (0.41) MAPTLMNACCR3NPSR1L3MBTL1
SCHEMBL8712537 0.85 CCR3 (0.43) MAPTLMNACCR3NPSR1L3MBTL1
SCHEMBL8665525 0.84 CCR3 (0.40) MAPTLMNACCR3NPSR1L3MBTL1
SCHEMBL8668024 0.82 CCR3 (0.35) MAPTLMNACCR3NPSR1L3MBTL1
SCHEMBL8577127 0.80 LMNA (0.41) MAPTLMNANPSR1L3MBTL1TSHR
SCHEMBL8668022 0.80 FPR1 (0.36) CCR3NPSR1L3MBTL1FPR2FPR1
SCHEMBL8485062 0.80 MAPT (0.40) MAPTLMNACCR3NPSR1L3MBTL1

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 claimed
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