SCHEMBL17360714

SCHEMBL17360714

COc1ccc2c(Br)c(Br)sc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRNP P04156 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
PPARG P37231 1/20 0.46
HTT P42858 1/20 0.46
MAPK10 P53779 1/20 0.46
NCOA2 Q15596 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
ALDH1A1 P00352 4/20 0.43
MAPT P10636 4/20 0.43
KDM4E B2RXH2 2/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
PSMB8 P28062 1/20 0.42
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42
TUBB4A P04350 2/20 0.41
TUBB P07437 2/20 0.41
TUBA3C P0DPH7 2/20 0.41

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
SCHEMBL3967129 0.84 CES2 (0.49) PRNPTSHRMAPK1PPARGHTT
SCHEMBL5089818 0.84 TSHR (0.45) PRNPTSHRMAPK1PPARGHTT
SCHEMBL6832588 0.80 TUBB4A (0.57) PRNPTSHRMAPK1PPARGHTT
SCHEMBL20425283 0.77 TUBB4A (0.51) PRNPTSHRMAPK1PPARGHTT
SCHEMBL15954746 0.77 TUBB4A (0.48) PRNPTSHRMAPK1PPARGHTT
SCHEMBL21176572 0.77 TUBB4A (0.42) PRNPTSHRMAPK1PPARGHTT
SCHEMBL10369463 0.77 CA2 (0.52) PRNPTSHRMAPK1PPARGHTT
SCHEMBL30610956 0.77 TUBB4A (0.51) PRNPTSHRMAPK1PPARGHTT
SCHEMBL10031374 0.76 HTT (0.51) PRNPTSHRMAPK1PPARGHTT
SCHEMBL7107022 0.76 L3MBTL1 (0.49) PRNPTSHRMAPK1PPARGHTT

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-2958907-A1 BENZOTHIOPHENE DERIVATIVES AND COMPOSITIONS THEREOF AS SELECTIVE ESTROGEN RECEPTOR DEGRADERS Novartis AG (CH) 2015-12-30 EP disclosed