SCHEMBL6511151

SCHEMBL6511151

Cc1ccc(F)c(CN(CCC(=O)O)Cc2cccc(Cc3ccccc3)c2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.43
HTT P42858 1/20 0.41
LMNA P02545 1/20 0.39
PKM P14618 1/20 0.39
PTGS2 P35354 2/20 0.38
MEP1B Q16820 2/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
PTPN1 P18031 2/20 0.37
LTA4H P09960 2/20 0.37
SLC1A5 Q15758 1/20 0.37
ABCB11 O95342 1/20 0.37
PTGS1 P23219 1/20 0.37
PPARG P37231 1/20 0.37
NR1I3 Q14994 1/20 0.37
PTGER1 P34995 1/20 0.37
PTGER4 P35408 1/20 0.37
PTGER3 P43115 1/20 0.37
PTGER2 P43116 1/20 0.37
FFAR1 O14842 1/20 0.37

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
SCHEMBL6510202 0.91 NPC1 (0.41) RAB9AMEP1BMTNR1AMTNR1BPTPN1
SCHEMBL6510100 0.89 FFAR1 (0.41) RAB9AHTTPTGS2MEP1BMTNR1A
SCHEMBL6510335 0.88 HTT (0.43) RAB9AHTTLMNAPKMMEP1B
SCHEMBL6509679 0.88 SMN1; SMN2 (0.45) HTTLMNAPKMPTPN1SLC1A5
SCHEMBL6512357 0.87 TAS2R14 (0.43) RAB9AHTTLMNAMEP1BMTNR1A
SCHEMBL6512693 0.87 TSHR (0.49) RAB9APPARGPTGER3FFAR1FFAR4
SCHEMBL6514104 0.86 KMT2A (0.42) HTTLMNAPKMMEP1BPTPN1
SCHEMBL6509442 0.86 RAB9A (0.41) RAB9AHTTLMNAPKMPTGS2
SCHEMBL6510860 0.86 RAB9A (0.41) RAB9AHTTPPARGPTGER1PTGER4
SCHEMBL6511925 0.85 HTT (0.51) RAB9AHTTLMNAPKMMEP1B

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-2005097100-A2 ANTIBACTERIAL AGENTS PROLYSIS LTD. (GB) 2005-10-20 WO disclosed