SCHEMBL3458686

SCHEMBL3458686

COc1cc(CBr)ccc1Oc1ccc(C(F)(F)F)cn1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.55
TSHR P16473 1/20 0.55
HPGD P15428 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.52
MAPT P10636 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPK1 P28482 1/20 0.46
THRB P10828 1/20 0.44
LIPE Q05469 4/20 0.44
POLB P06746 2/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 1/20 0.40
NPSR1 Q6W5P4 1/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38

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
SCHEMBL6906429 0.83 SMN1; SMN2 (0.51) SMN1; SMN2TSHRHPGDL3MBTL1LIPE
SCHEMBL30997486 0.81 L3MBTL1 (0.50) SMN1; SMN2TSHRHPGDL3MBTL1MAPT
SCHEMBL29265119 0.81 L3MBTL1 (0.50) SMN1; SMN2TSHRHPGDL3MBTL1MAPT
SCHEMBL11114747 0.78 TSHR (0.76) SMN1; SMN2TSHRHPGDL3MBTL1MAPT
SCHEMBL8304006 0.78 SMN1; SMN2 (0.55) SMN1; SMN2TSHRHPGDL3MBTL1MAPT
SCHEMBL2699714 0.78 MAPT (0.58) SMN1; SMN2TSHRHPGDL3MBTL1MAPT
SCHEMBL7943027 0.77 THRB (0.58) HPGDMAPTKMT2AMAPK1THRB
SCHEMBL31360360 0.75 THRB (0.64) SMN1; SMN2TSHRHPGDL3MBTL1MAPT
SCHEMBL2181810 0.74 SMN1; SMN2 (0.50) SMN1; SMN2TSHRHPGDMAPTKMT2A
SCHEMBL28286591 0.74 MAPT (0.60) SMN1; SMN2TSHRMAPTKMT2AMAPK1

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
WO-2010010435-A2 FUSED OXAZOLE AND THIAZOLE DERIVATIVES AS TRPMS MODULATORS GLENMARK PHARMACEUTICAL S.A. (CH) 2010-01-28 WO disclosed