SCHEMBL14765488

SCHEMBL14765488

C=Cc1ccc(OCc2nc(-c3ccccc3Cl)cs2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.45
ALDH1A1 P00352 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CYP19A1 P11511 1/20 0.43
GSTO1 P78417 1/20 0.43
MAPT P10636 6/20 0.42
TDP1 Q9NUW8 1/20 0.42
PTPN2 P17706 1/20 0.42
PTPN1 P18031 1/20 0.42
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
POLB P06746 1/20 0.39
ATP4A P20648 2/20 0.39
ATP4B P51164 2/20 0.39
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
BCHE P06276 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
CYP1A1 P04798 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
SCHEMBL14765483 0.87 L3MBTL1 (0.45) L3MBTL1ALDH1A1NPSR1CYP19A1GSTO1
SCHEMBL14765480 0.86 L3MBTL1 (0.53) L3MBTL1ALDH1A1NPSR1CYP19A1MAPT
SCHEMBL14765481 0.84 MAPT (0.47) L3MBTL1ALDH1A1NPSR1CYP19A1MAPT
SCHEMBL14765485 0.84 BCHE (0.49) L3MBTL1ALDH1A1NPSR1CYP19A1MAPT
SCHEMBL14765475 0.84 L3MBTL1 (0.55) L3MBTL1ALDH1A1NPSR1CYP19A1MAPT
SCHEMBL13484552 0.82 ESR1 (0.46) L3MBTL1ALDH1A1NPSR1GSTO1MAPT
SCHEMBL14765465 0.82 EPHA2 (0.42) L3MBTL1ALDH1A1NPSR1CYP19A1GSTO1
SCHEMBL14765470 0.82 SMN1; SMN2 (0.43) L3MBTL1ALDH1A1NPSR1CYP19A1GSTO1
SCHEMBL14765486 0.81 L3MBTL1 (0.45) L3MBTL1ALDH1A1NPSR1CYP19A1MAPT
SCHEMBL13484565 0.80 NPC1 (0.60) L3MBTL1ALDH1A1NPSR1CYP19A1MAPT

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
US-8394841-B2 Compounds and methods for modulating G protein-coupled receptors IRM LLC (BM) 2013-03-12 US disclosed