SCHEMBL17490271

SCHEMBL17490271

Cc1c(O)c(Cl)c(C)c(O)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.44
HSD17B10 Q99714 4/20 0.44
ALDH1A1 P00352 4/20 0.44
MAPT P10636 4/20 0.44
TSHR P16473 3/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
LMNA P02545 2/20 0.44
CYP3A4 P08684 2/20 0.38
ALOX15 P16050 2/20 0.38
CHRM1 P11229 1/20 0.38
MAOA P21397 1/20 0.38
TBXA2R P21731 1/20 0.38
ADRA1A P35348 1/20 0.38
HTR2B P41595 1/20 0.38
CASP1 P29466 1/20 0.35
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
GAA P10253 1/20 0.33
MAPK1 P28482 2/20 0.32

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
SCHEMBL24462646 0.93 HPGD (0.39) HPGDHSD17B10ALDH1A1MAPTTSHR
SCHEMBL6063823 0.86 TSHR (0.56) HPGDHSD17B10ALDH1A1MAPTTSHR
SCHEMBL3221262 0.86 HPGD (0.39) HPGDHSD17B10ALDH1A1MAPTTSHR
SCHEMBL5587483 0.85 HPGD (0.44) HPGDHSD17B10ALDH1A1MAPTTSHR
SCHEMBL2050463 0.83 HPGD (0.37) HPGDHSD17B10ALDH1A1MAPTTSHR
SCHEMBL3308498 0.83 TSHR (0.44) HPGDHSD17B10ALDH1A1MAPTTSHR
SCHEMBL11060919 0.83 HPGD (0.37) HPGDHSD17B10ALDH1A1MAPTTSHR
SCHEMBL11509242 0.81 TSHR (0.50) HPGDHSD17B10ALDH1A1MAPTTSHR
SCHEMBL10577820 0.81 TSHR (0.50) HPGDHSD17B10ALDH1A1MAPTTSHR
SCHEMBL9650992 0.81 HPGD (0.41) HPGDHSD17B10ALDH1A1MAPTTSHR

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-9620297-B2 Electricity storage device and electrode material therefor TOHOKU UNIVERSITY (JP) 2017-04-11 US disclosed
US-20160035498-A1 ELECTRICITY STORAGE DEVICE AND ELECTRODE MATERIAL THEREFOR TOHOKU UNIVERSITY (JP) 2016-02-04 US disclosed