SCHEMBL14765485

SCHEMBL14765485

Cc1ccc(OCc2nc(-c3ccccc3Cl)cs2)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BCHE P06276 5/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
ALDH1A1 P00352 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
MAPT P10636 7/20 0.46
TDP1 Q9NUW8 1/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
CYP19A1 P11511 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
KDM4E B2RXH2 1/20 0.42
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42

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
SCHEMBL14765481 0.90 MAPT (0.47) L3MBTL1ALDH1A1NPSR1MAPTTDP1
SCHEMBL14765475 0.90 L3MBTL1 (0.55) L3MBTL1ALDH1A1NPSR1MAPTTDP1
SCHEMBL14765480 0.89 L3MBTL1 (0.53) L3MBTL1ALDH1A1NPSR1MAPTTDP1
SCHEMBL14765486 0.86 L3MBTL1 (0.45) BCHEL3MBTL1ALDH1A1NPSR1MAPT
SCHEMBL14765488 0.84 L3MBTL1 (0.45) BCHEL3MBTL1ALDH1A1NPSR1MAPT
SCHEMBL13484545 0.83 PPARD (0.53) L3MBTL1ALDH1A1NPSR1MAPTNPC1
SCHEMBL13484565 0.83 NPC1 (0.60) L3MBTL1ALDH1A1NPSR1MAPTNPC1
SCHEMBL14765476 0.81 CYP1A2 (0.50) L3MBTL1ALDH1A1NPSR1MAPTTDP1
SCHEMBL13484542 0.81 PPARD (0.50) L3MBTL1ALDH1A1NPSR1MAPTNPC1
SCHEMBL13484547 0.81 PPARG (0.48) BCHEL3MBTL1ALDH1A1NPSR1MAPT

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