SCHEMBL7656906

SCHEMBL7656906

CCOc1ccc(CCNC(=S)Nc2ccc(C(N)=O)cc2)cc1OCC

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.66
KMT2A Q03164 8/20 0.53
MEN1 O00255 7/20 0.53
POLB P06746 1/20 0.53
ALDH1A1 P00352 4/20 0.53
GAA P10253 4/20 0.53
ALOX12 P18054 2/20 0.53
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 1/20 0.50
HPGD P15428 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC2 Q92769 1/20 0.48

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
SCHEMBL6815478 0.88 MAPT (0.77) MAPTKMT2AMEN1ALDH1A1GAA
SCHEMBL7656920 0.86 MAPT (0.56) MAPTKMT2AMEN1POLBALDH1A1
SCHEMBL7589800 0.82 MAPT (0.65) MAPTKMT2AMEN1ALDH1A1GAA
SCHEMBL7569736 0.81 MAPT (0.62) MAPTKMT2AMEN1POLBALDH1A1
SCHEMBL6814660 0.79 MAPT (0.62) MAPTKMT2AMEN1POLBALDH1A1
SCHEMBL7645910 0.78 MAPT (0.80) MAPTKMT2AMEN1POLBALDH1A1
SCHEMBL6816087 0.78 MAPT (0.57) MAPTKMT2AMEN1ALDH1A1GAA
SCHEMBL7568740 0.78 MAPT (0.58) MAPTKMT2AMEN1POLBALDH1A1
SCHEMBL6815173 0.78 MAPT (0.60) MAPTKMT2AMEN1POLBALDH1A1
SCHEMBL7656912 0.77 KMT2A (0.48) MAPTKMT2AMEN1ALDH1A1GAA

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-6407249-B1 COMPOUNDS CONTAINING FURAN RING STRUCTURE AMERICAN HOME PRODUCTS CORPORATION 2002-06-18 US disclosed