SCHEMBL2839819

SCHEMBL2839819

O=C(O)C(CCBr)CCCCCCCCCCCS

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 11/20 0.67
CPB2 Q96IY4 4/20 0.48
CPN1 P15169 1/20 0.37
GRIK1 P39086 1/20 0.37
GRIK2 Q13002 1/20 0.37
CHRM1 P11229 1/20 0.37
AKR1A1 P14550 1/20 0.37
CHRM3 P20309 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
ADRA1A P35348 1/20 0.37
HRH1 P35367 1/20 0.37
DRD3 P35462 1/20 0.37
SLC6A3 Q01959 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL3521470 0.87 FOLH1 (0.77) FOLH1CPB2CHRM1AKR1A1CHRM3
SCHEMBL3517925 0.85 FOLH1 (0.74) FOLH1CPB2CPN1GRIK1GRIK2
SCHEMBL3517121 0.85 FOLH1 (0.76) FOLH1CPB2CHRM1AKR1A1CHRM3
SCHEMBL3515562 0.83 FOLH1 (0.73) FOLH1CPB2CPN1CHRM1AKR1A1
SCHEMBL3520055 0.81 CPB2 (0.70) FOLH1CPB2CPN1
SCHEMBL4410902 0.81 CHRM1 (0.44) FOLH1CPB2GRIK1GRIK2CHRM1
SCHEMBL3516022 0.80 FOLH1 (0.78) FOLH1CPB2CPN1CHRM1AKR1A1
SCHEMBL6120281 0.80 GRIK1 (0.58) GRIK1GRIK2CHRM1AKR1A1CHRM3
SCHEMBL10562619 0.80 GRIK1 (0.58) GRIK1GRIK2CHRM1AKR1A1CHRM3
SCHEMBL11356676 0.80 FOLH1 (0.67) FOLH1CPB2GRIK1GRIK2CHRM1

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
US-8377635-B2 Microfluidic device ALERE SWITZERLAND GMBH (CH) 2013-02-19 US disclosed
US-20100210037-A1 Microfluidic Device Abbott Rapid Diagnostics International Unlimited Company (IE) 2010-08-19 US disclosed
EP-1993731-A1 MICROFLUIDIC DEVICE Inverness Medical Switzerland GmbH (CH) 2008-11-26 EP disclosed
WO-2007091097-A1 MICROFLUIDIC DEVICE INVERNESS MEDICAL SWITZERLAND GMBH (CH) 2007-08-16 WO disclosed