SCHEMBL23368144

SCHEMBL23368144

COC(=O)C(C)Oc1ccc(Cl)c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
LMNA P02545 1/20 0.50
ESRRA P11474 4/20 0.47
KMT2A Q03164 5/20 0.45
MEN1 O00255 3/20 0.45
MAPT P10636 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
F9 P00740 1/20 0.44
PLAU P00749 1/20 0.44
NPSR1 Q6W5P4 2/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
TDP1 Q9NUW8 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.40
FFAR1 O14842 1/20 0.40

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
SCHEMBL18331090 1.00 TSHR (0.54) TSHRNPC1RAB9ALMNAESRRA
SCHEMBL18321311 0.84 KMT2A (0.54) TSHRNPC1RAB9ALMNAESRRA
SCHEMBL10778046 0.84 KMT2A (0.54) TSHRNPC1RAB9ALMNAESRRA
SCHEMBL10778105 0.84 TSHR (0.53) TSHRNPC1RAB9ALMNAESRRA
SCHEMBL28729952 0.81 KMT2A (0.56) LMNAKMT2AMEN1MAPTL3MBTL1
Lonaprofen SCHEMBL2109183 0.79 NCEH1 (0.56) NPC1RAB9ALMNAKMT2AMEN1
Lonaprofen SCHEMBL29670159 0.79 NCEH1 (0.56) NPC1RAB9ALMNAKMT2AMEN1
SCHEMBL9563096 0.79 PKM (0.49) TSHRLMNAESRRAKMT2AMEN1
SCHEMBL10781651 0.77 LMNA (0.63) TSHRNPC1RAB9ALMNAESRRA
SCHEMBL9711019 0.77 F9 (0.51) KMT2AMEN1MAPTF9PLAU

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-3307262-B1 COMPOUNDS FOR USE IN TREATING NEUROMUSCULAR DISORDERS NMD PHARMA AS (DK) 2021-05-19 EP disclosed