SCHEMBL7704502

SCHEMBL7704502

CCC1OC1CCCC(=O)CCCCCC1CO1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
SPHK2 Q9NRA0 3/20 0.33
SPHK1 Q9NYA1 3/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
THRB P10828 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
EPHX1 P07099 1/20 0.32
ENPP2 Q13822 1/20 0.32
LPAR2 Q9HBW0 1/20 0.32
ALOX5 P09917 1/20 0.31
PRKD3 O94806 1/20 0.30
PRKCG P05129 1/20 0.30
PRKCB P05771 1/20 0.30
PRKCA P17252 1/20 0.30
PRKCH P24723 1/20 0.30
PRKCI P41743 1/20 0.30
PRKCE Q02156 1/20 0.30
PRKCQ Q04759 1/20 0.30
PRKCZ Q05513 1/20 0.30

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
SCHEMBL4973388 0.85 ALDH1A1 (0.49) ALDH1A1SPHK2SPHK1MAPTKMT2A
SCHEMBL5694697 0.84 ALDH1A1 (0.43) ALDH1A1SPHK2SPHK1MAPTKMT2A
SCHEMBL30837971 0.82 ALDH1A1 (0.52) ALDH1A1MAPTKMT2ATHRBSMN1; SMN2
SCHEMBL9686164 0.80 ALDH1A1 (0.70) ALDH1A1MAPTKMT2AEPHX1ALOX5
SCHEMBL23827552 0.80 ALDH1A1 (0.50) ALDH1A1SPHK2SPHK1SMN1; SMN2EPHX1
SCHEMBL2482201 0.75 GPR84 (0.48) ALDH1A1KMT2AALOX5
SCHEMBL11538646 0.75 GPR84 (0.48) ALDH1A1KMT2AALOX5
SCHEMBL13170650 0.75 ALDH1A1 (0.48) ALDH1A1THRBSMN1; SMN2EPHX1
SCHEMBL9294130 0.75 ALDH1A1 (0.79) ALDH1A1SPHK2SPHK1SMN1; SMN2EPHX1
SCHEMBL12290729 0.75 ALDH1A1 (0.79) ALDH1A1SPHK2SPHK1SMN1; SMN2EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1208118-A2 PRODUCTION OF HAZE-FREE BLOCK COPOLYMERS ATOFINA Research (BE) 2002-05-29 EP disclosed
EP-1192190-A1 PRODUCTION OF HAZE-FREE BLOCK COPOLYMERS ATOFINA Research (BE) 2002-04-03 EP disclosed
WO-2000077052-A2 PRODUCTION OF HAZE-FREE BLOCK COPOLYMERS ATOFINA RESEARCH (BE) 2000-12-21 WO disclosed
WO-2000077051-A1 PRODUCTION OF HAZE-FREE BLOCK COPOLYMERS ATOFINA RESEARCH (BE) 2000-12-21 WO disclosed