SCHEMBL14865993

SCHEMBL14865993

CCCSC1=C(SCCC)SC(=C2SC(SCCC)=C(SCCSC)S2)S1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
ESR1 P03372 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
ALOX12 P18054 1/20 0.36
MCL1 Q07820 1/20 0.36
ESR2 Q92731 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL14866140 1.00 ALDH1A1 (0.36) ALDH1A1ESR1MAPTHPGDALOX15
SCHEMBL14865927 0.91 ALDH1A1 (0.41) ALDH1A1ESR1MAPTHPGDALOX15
SCHEMBL14866166 0.78 ALDH1A1 (0.36) ALDH1A1ESR1MAPTHPGDALOX15
SCHEMBL14865992 0.78 ALDH1A1 (0.36) ALDH1A1ESR1MAPTHPGDALOX15
SCHEMBL14865984 0.78 ALDH1A1 (0.36) ALDH1A1ESR1MAPTHPGDALOX15
SCHEMBL14866139 0.78 ALDH1A1 (0.36) ALDH1A1ESR1MAPTHPGDALOX15
SCHEMBL18923411 0.77
SCHEMBL18862214 0.77 ALDH1A1 (0.41) ALDH1A1ESR1MAPTHPGDALOX15
SCHEMBL18923321 0.76 ALDH1A1 (0.60) ALDH1A1ESR1MAPTHPGDALOX15
SCHEMBL12264191 0.72 ALDH1A1 (0.33) ALDH1A1ESR1MAPTHPGDALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9671392-B2 Multisensor array for detection of analytes or mixtures thereof in gas or liquid phase DANMARKS TEKNISKE UNIVERSITET (DK) 2017-06-06 US disclosed
US-20130096030-A1 MULTISENSOR ARRAY FOR DETECTION OF ANALYTES OR MIXTURES THEREOF IN GAS OR LIQUID PHASE SYDDANSK UNIVERSITET (DK) 2013-04-18 US disclosed