SCHEMBL5729888

SCHEMBL5729888

CCCCCc1cccc(P)c1CCCCC

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.47
ALOX5 P09917 1/20 0.46
PTGS2 P35354 1/20 0.46
BID P55957 3/20 0.44
MCL1 Q07820 3/20 0.44
BCL2L1 Q07817 2/20 0.44
BAK1 Q16611 2/20 0.44
KAT8 Q9H7Z6 2/20 0.44
PPARA Q07869 2/20 0.44
PPARG P37231 1/20 0.44
EP300 Q09472 1/20 0.44
KAT2A Q92830 1/20 0.44
KAT2B Q92831 1/20 0.44
KAT5 Q92993 1/20 0.44
SAE1 Q9UBE0 1/20 0.44
KCNH2 Q12809 2/20 0.42
TYR P14679 1/20 0.41
CYSLTR2 Q9NS75 5/20 0.40
CYSLTR1 Q9Y271 5/20 0.40

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
Hydrochloric Acid SCHEMBL29193922 0.98 LIPG (0.46) LIPGALOX5PTGS2BIDMCL1
SCHEMBL6285351 0.98 LIPG (0.50) LIPGALOX5PTGS2BIDMCL1
SCHEMBL9113466 0.98 LIPG (0.50) LIPGALOX5PTGS2BIDMCL1
SCHEMBL339550 0.98 LIPG (0.50) LIPGALOX5PTGS2BIDMCL1
SCHEMBL2922724 0.98 LIPG (0.50) LIPGALOX5PTGS2BIDMCL1
SCHEMBL29210030 0.98 LIPG (0.50) LIPGALOX5PTGS2BIDMCL1
SCHEMBL6279009 0.98 LIPG (0.50) LIPGALOX5PTGS2BIDMCL1
SCHEMBL301548 0.94 LIPG (0.40) LIPGALOX5PTGS2BIDMCL1
SCHEMBL11228913 0.90 BID (0.42) LIPGALOX5PTGS2BIDMCL1
SCHEMBL11225510 0.89 BID (0.45) LIPGALOX5PTGS2BIDMCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1252551-B1 PHOTOINITIATOR SYSTEM WITH ACYLPHOSPHINE OXIDE INITIATORS S & C POLYMER SILICON & COMPOS (DE) 2006-07-19 EP claimed
WO-2016076437-A1 COMPOSITION FOR KERATIN FIBERS L'OREAL (FR) 2016-05-19 WO disclosed
WO-2013145330-A1 PROCESS FOR TREATING KERATIN FIBERS L'OREAL (FR) 2013-10-03 WO disclosed
US-4661623-A CATALYST SELECTIVITY ASHLAND OIL, INC. (US) 1987-04-28 US disclosed
US-4257973-A USING ORGANOPHOSPHORUS-PALLADIUM HALIDE COORDINATION CATALYST E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-03-24 US disclosed