SCHEMBL7705794

SCHEMBL7705794

O=C(O)CCCCCCC#Cc1ccccc1F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR2 Q9NS75 1/20 0.49
▸ CYSLTR1 Q9Y271 1/20 0.49
▸ HCAR2 Q8TDS4 1/20 0.48
▸ PTPN7 P35236 3/20 0.44
▸ HMGCR P04035 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ HDAC3 O15379 1/20 0.44
▸ HDAC4 P56524 1/20 0.44
▸ HDAC1 Q13547 1/20 0.44
▸ HDAC7 Q8WUI4 1/20 0.44
▸ HDAC2 Q92769 1/20 0.44
▸ HDAC10 Q969S8 1/20 0.44
▸ HDAC11 Q96DB2 1/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44
▸ HDAC6 Q9UBN7 1/20 0.44
▸ HDAC9 Q9UKV0 1/20 0.44
▸ HDAC5 Q9UQL6 1/20 0.44
▸ MME P08473 2/20 0.43
▸ ECE1 P42892 2/20 0.43

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
SCHEMBL7705797 0.81 FFAR1 (0.53) CYSLTR2CYSLTR1PTPN7HMGCRMAPT
SCHEMBL8352544 0.79 FFAR1 (0.57) PTPN7HMGCRMAPTRXFP1HDAC3
SCHEMBL10592931 0.79 FFAR1 (0.57) PTPN7HMGCRMAPTRXFP1HDAC3
SCHEMBL10795247 0.79 CYSLTR2 (0.65) CYSLTR2CYSLTR1PTPN7HMGCRMAPT
SCHEMBL7705813 0.78 FFAR1 (0.55) CYSLTR2CYSLTR1PTPN7HMGCRMAPT
SCHEMBL7680525 0.78 KCNH2 (0.50) CYSLTR2CYSLTR1HCAR2MAPTKDM4E
SCHEMBL7683468 0.78 KCNH2 (0.50) CYSLTR2CYSLTR1HCAR2MAPTKDM4E
SCHEMBL14007856 0.77 FFAR1 (0.57) PTPN7HMGCRMAPTRXFP1HDAC3
SCHEMBL15022608 0.77 KDM4E (0.57) HCAR2MAPTMMEECE1KDM4E
SCHEMBL27809224 0.76 FFAR1 (0.56) PTPN7HMGCRMAPTRXFP1HDAC3

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6355490-B1 CODING INDIVIDUAL MEMBERS OF LIBRARY; COVALENTLY BONDING NITRILE TO SOLID SUPPORT; DETECTION BY INFRARED OR RAMAN SPECTROSCOPY ABBOTT LABORATORIES 2002-03-12 — — US disclosed
US-6274385-B1 COVALENTLY ATTACHING TO EACH SOLID SUPPORT AT LEAST ONE ACETYLENE CODING IDENTIFIER DETECTABLE BY INFRARED OR RAMAN SPECTROSCOPY TO CODE INDIVIDUAL MEMBERS OF A COMBINATORIAL CHEMICAL LIBRARY ABBOTT LABORATORIES 2001-08-14 — — US disclosed
EP-0879219-B1 ATTACHED TAGS FOR USE IN COMBINATORIAL CHEMISTRY SYNTHESIS ABBOTT LAB (US) 2000-03-01 — — EP disclosed
EP-0879219-A1 ATTACHED TAGS FOR USE IN COMBINATORIAL CHEMISTRY SYNTHESIS Abbott Laboratories (US) 1998-11-25 — — EP disclosed
WO-1998011036-A9 ATTACHED TAGS FOR USE IN COMBINATORIAL CHEMISTRY SYNTHESIS — 1998-07-09 — — WO disclosed
WO-1998011036-A1 ATTACHED TAGS FOR USE IN COMBINATORIAL CHEMISTRY SYNTHESIS ABBOTT LABORATORIES (US) 1998-03-19 — — WO disclosed
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