SCHEMBL6509442

SCHEMBL6509442

Cc1ccc(F)c(CN(CCC(=O)O)Cc2cccc(Sc3ccccc3)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.41
HTT P42858 1/20 0.39
HTR2C P28335 1/20 0.38
HTR6 P50406 1/20 0.38
LMNA P02545 1/20 0.37
PKM P14618 1/20 0.37
PTGS2 P35354 2/20 0.36
MEP1B Q16820 2/20 0.36
SLC1A5 Q15758 1/20 0.36
ABCB11 O95342 1/20 0.35
PTGS1 P23219 1/20 0.35
PPARG P37231 1/20 0.35
NR1I3 Q14994 1/20 0.35
PTGER1 P34995 1/20 0.35
PTGER4 P35408 1/20 0.35
PTGER3 P43115 1/20 0.35
PTGER2 P43116 1/20 0.35
PTPN1 P18031 1/20 0.35
FFAR1 O14842 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35

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
SCHEMBL6518329 0.91 NPC1 (0.39) RAB9AHTR2CHTR6PTGS2MEP1B
SCHEMBL6510314 0.89 HPGD (0.40) HTTHTR2CHTR6PTGS2MEP1B
SCHEMBL6510768 0.88 ALDH1A1 (0.43) RAB9AHTTHTR2CHTR6LMNA
SCHEMBL6511151 0.86 RAB9A (0.43) RAB9AHTTLMNAPKMPTGS2
SCHEMBL6533747 0.85 ATM (0.36) RAB9AHTTPTGS2PTGER1PTGER4
SCHEMBL6510665 0.85 MEP1B (0.39) HTTLMNAMEP1BSLC1A5KDM4E
SCHEMBL6532728 0.84 ATM (0.39) RAB9AHTTPTGS2MEP1BABCB11
SCHEMBL6512693 0.84 TSHR (0.49) RAB9APPARGPTGER3FFAR1FFAR4
SCHEMBL6509513 0.84 SLC6A9 (0.41) LMNAPKMMEP1BFFAR1ALDH1A1
SCHEMBL6511749 0.83 HTT (0.38) RAB9AHTTHTR2CHTR6LMNA

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