SCHEMBL5433772

SCHEMBL5433772

CCN(C(=S)NF)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.63
ALDH1A1 P00352 4/20 0.55
MAPT P10636 1/20 0.55
THRB P10828 1/20 0.55
PKM P14618 1/20 0.55
HPGD P15428 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
KDM4E B2RXH2 1/20 0.54
GLA P06280 1/20 0.53
TSHR P16473 1/20 0.53
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.42
HTT P42858 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
SCHEMBL11528334 0.83 L3MBTL1 (0.65) L3MBTL1ALDH1A1MAPTTHRBPKM
SCHEMBL7987611 0.81 L3MBTL1 (0.73) L3MBTL1ALDH1A1MAPTTHRBPKM
SCHEMBL11170994 0.80 L3MBTL1 (0.61) L3MBTL1ALDH1A1MAPTTHRBPKM
SCHEMBL4603063 0.78 ALDH1A1 (0.63) L3MBTL1ALDH1A1MAPTTHRBPKM
SCHEMBL1276930 0.78 ALDH1A1 (0.63) L3MBTL1ALDH1A1MAPTTHRBPKM
SCHEMBL11423478 0.78 ALDH1A1 (0.63) L3MBTL1ALDH1A1MAPTTHRBPKM
SCHEMBL4294745 0.78 MEN1 (0.67) L3MBTL1ALDH1A1MAPTHPGDSMN1; SMN2
SCHEMBL1024200 0.77 ALDH1A1 (0.57) L3MBTL1ALDH1A1MAPTTHRBPKM
SCHEMBL5458866 0.76 ALDH1A1 (0.61) L3MBTL1ALDH1A1MAPTTHRBPKM
SCHEMBL11529582 0.76 L3MBTL1 (0.65) L3MBTL1ALDH1A1MAPTTHRBPKM

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-7220768-B2 Isoxazole-containing thiourea inhibitors useful for treatment of varicella zoster virus WYETH HOLDINGS CORP. (US) 2007-05-22 US disclosed