SCHEMBL16200089

SCHEMBL16200089

CCOc1cc(CC)c(F)cc1Br

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
MAPT P10636 2/20 0.37
HPGD P15428 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
HTR2A P28223 2/20 0.37
HTR2C P28335 2/20 0.37
HTR2B P41595 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KMT2A Q03164 1/20 0.37
NCOA1 Q15788 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36
HTT P42858 1/20 0.36
TAAR1 Q96RJ0 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
SCHEMBL29775469 0.82 LMNA (0.52) LMNATSHRHSD17B10L3MBTL1MAPT
SCHEMBL23326296 0.82 LMNA (0.52) LMNATSHRHSD17B10L3MBTL1MAPT
SCHEMBL4472996 0.78 TSHR (0.46) LMNATSHRHSD17B10ALDH1A1GAA
SCHEMBL23326208 0.78 HTR2A (0.51) LMNATSHRHSD17B10HTR2AHTR2C
SCHEMBL7893305 0.78 ALDH1A1 (0.43) LMNATSHRHSD17B10ALDH1A1GAA
SCHEMBL7797921 0.77 TSHR (0.54) LMNATSHRHSD17B10ALDH1A1GAA
SCHEMBL10967724 0.77 LMNA (0.57) LMNATSHRHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL8407819 0.76 ALDH1A1 (0.45) LMNATSHRHSD17B10ALDH1A1GAA
SCHEMBL14292894 0.76 KDM1A (0.39)
SCHEMBL9954912 0.76 HTR2A (0.49) ALDH1A1HTR2AHTR2CTAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1720545-B1 BICYCLIC AND BRIDGED NITROGEN HETEROCYCLES CHEMOCENTRYX INC (US) 2014-10-29 EP disclosed