SCHEMBL184986

SCHEMBL184986

CCCCc1[c]cc(C=O)c(O)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.39
NPC1 O15118 1/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TYR P14679 3/20 0.34
KDM4E B2RXH2 1/20 0.34
PKM P14618 1/20 0.34
ERN1 O75460 6/20 0.33
TRIM24 O15164 1/20 0.33
TRIM33 Q9UPN9 1/20 0.33
EGFR P00533 1/20 0.31

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
SCHEMBL9056784 0.76 TYR (0.50) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL27904720 0.75 TYR (0.49) CDK1NPC1HPGDMAPK1HTT
SCHEMBL28002390 0.71 TYR (0.41) CDK1NPC1HPGDMAPK1HTT
SCHEMBL305915 0.70 CDK1 (0.77) CDK1NPC1HPGDMAPK1HTT
SCHEMBL1527086 0.70 CDK1 (0.57) CDK1NPC1HPGDMAPK1HTT
SCHEMBL8154554 0.69 TYR (0.51) CDK1HPGDHTTNPSR1TYR
SCHEMBL1527130 0.69 TYR (0.51) CDK1HPGDHTTNPSR1TYR
SCHEMBL11297175 0.69 TYR (0.51) CDK1HPGDHTTNPSR1TYR
Alcohol SCHEMBL28646336 0.68 ERN1 (0.45) CDK1TYRERN1TRIM24TRIM33
SCHEMBL20451183 0.68 CDK1 (0.46) CDK1NPC1HPGDMAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2401076-A1 ALKOXYLATION PROCESSES AND CATALYSTS THEREFOR Dow Global Technologies LLC (US) 2012-01-04 EP disclosed
EP-2401075-A1 ALKOXYLATION PROCESSES AND CATALYSTS THEREFOR Dow Global Technologies LLC (US) 2012-01-04 EP disclosed
EP-2401074-A1 ALKOXYLATION PROCESSES AND CATALYSTS THEREFOR Dow Global Technologies LLC (US) 2012-01-04 EP disclosed
EP-2401313-A1 EPOXY RESIN PRODUCTION Dow Global Technologies LLC (US) 2012-01-04 EP disclosed
WO-2010099295-A1 EPOXY RESIN PRODUCTION DOW GLOBAL TECHNOLOGIES INC. (US) 2010-09-02 WO disclosed
WO-2010099309-A1 ALKOXYLATION PROCESSES AND CATALYSTS THEREFOR DOW GLOBAL TECHNOLOGIES INC. (US) 2010-09-02 WO disclosed
WO-2010099300-A1 ALKOXYLATION PROCESSES AND CATALYSTS THEREFOR DOW GLOBAL TECHNOLOGIES INC. (US) 2010-09-02 WO disclosed
WO-2010099303-A1 ALKOXYLATION PROCESSES AND CATALYSTS THEREFOR DOW GLOBAL TECHNOLOGIES INC. (US) 2010-09-02 WO disclosed