SCHEMBL10123740

SCHEMBL10123740

CCC(CC(C)C(C)=O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 6/20 0.54
SLC1A3 P43003 5/20 0.54
SLC1A1 P43005 5/20 0.54
CA2 P00918 1/20 0.45
MAPK1 P28482 1/20 0.45
CHRM1 P11229 1/20 0.41
AKR1A1 P14550 1/20 0.41
CHRM3 P20309 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
ADRA1A P35348 1/20 0.41
HRH1 P35367 1/20 0.41
DRD3 P35462 1/20 0.41
SLC6A3 Q01959 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
GRIK1 P39086 2/20 0.36
GRIK2 Q13002 2/20 0.36
CPA1 P15085 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
SCHEMBL14037696 0.98 SLC1A2 (0.52) SLC1A2SLC1A3SLC1A1CA2MAPK1
SCHEMBL16902754 0.87 SLC1A3 (0.43) SLC1A2SLC1A3SLC1A1CA2MAPK1
SCHEMBL117765 0.86 SLC1A3 (0.58) SLC1A2SLC1A3SLC1A1CA2MAPK1
SCHEMBL12702098 0.86 TSHR (0.41) SLC1A2SLC1A3SLC1A1CA2MAPK1
SCHEMBL12630685 0.84 SLC1A3 (0.56) SLC1A2SLC1A3SLC1A1CA2MAPK1
SCHEMBL9750996 0.84 SLC1A3 (0.56) SLC1A2SLC1A3SLC1A1CA2MAPK1
SCHEMBL17131773 0.84 SLC1A3 (0.56) SLC1A2SLC1A3SLC1A1CA2MAPK1
SCHEMBL9888775 0.84 SLC1A3 (0.56) SLC1A2SLC1A3SLC1A1CA2MAPK1
SCHEMBL15677327 0.84 SLC1A3 (0.56) SLC1A2SLC1A3SLC1A1CA2MAPK1
SCHEMBL164389 0.84 SLC1A3 (0.56) SLC1A2SLC1A3SLC1A1CA2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180044549-A1 SILICONE HYDROGEL LENSES WITH WATER-RICH SURFACES ALCON INC. (CH) 2018-02-15 US disclosed
US-9816009-B2 Silicone hydrogel lenses with water-rich surfaces NOVARTIS AG (CH) 2017-11-14 US disclosed
US-20160377885-A1 SILICONE HYDROGEL LENSES WITH WATER-RICH SURFACES ALCON INC. (CH) 2016-12-29 US disclosed
US-9411171-B2 Silicone hydrogel lenses with water-rich surfaces NOVARTIS AG (CH) 2016-08-09 US disclosed
US-20160097938-A1 SILICONE HYDROGEL LENSES WITH WATER-RICH SURFACES ALCON INC. (CH) 2016-04-07 US disclosed
US-20160097939-A1 SILICONE HYDROGEL LENSES WITH NANO-TEXTURED SURFACES ALCON INC. (CH) 2016-04-07 US disclosed
US-9244200-B2 Silicone hydrogel lenses with water-rich surfaces NOVARTIS AG (CH) 2016-01-26 US disclosed
US-20150092156-A1 SILICONE HYDROGEL LENSES WITH WATER-RICH SURFACES ALCON INC. (CH) 2015-04-02 US disclosed
US-8939577-B2 Silicone hydrogel lenses with water-rich surfaces NOVARTIS AG (CH) 2015-01-27 US disclosed
US-20130250234-A1 SILICONE HYDROGEL LENSES WITH WATER-RICH SURFACES NOVARTIS AG (CH) 2013-09-26 US disclosed
US-8480227-B2 Silicone hydrogel lenses with water-rich surfaces NOVARTIS AG (CH) 2013-07-09 US disclosed
US-20120026458-A1 SILICONE HYDROGEL LENSES WITH WATER-RICH SURFACES ALCON INC. (CH) 2012-02-02 US disclosed