SCHEMBL9669679

SCHEMBL9669679

CCOC(=O)n1[nH]c(=O)c2cccc(C)c21

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
MAPT P10636 3/20 0.45
GAA P10253 2/20 0.45
ALDH1A1 P00352 5/20 0.40
HPGD P15428 1/20 0.40
POLB P06746 1/20 0.40
KDM4E B2RXH2 3/20 0.38
HSD17B10 Q99714 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CLEC4M Q9H2X3 1/20 0.38
HTT P42858 1/20 0.38
USP2 O75604 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL5113974 0.79 ALDH1A1 (0.48) TSHRGAAALDH1A1HPGDPOLB
SCHEMBL16157907 0.71 KDM4E (0.53) TSHRMEN1KMT2AMAPTALDH1A1
SCHEMBL10436781 0.70 SMN1; SMN2 (0.49) MEN1KMT2AMAPTGAAALDH1A1
SCHEMBL8252276 0.69 ALDH1A1 (0.42) L3MBTL1MAPTALDH1A1KDM4ESMN1; SMN2
SCHEMBL2256676 0.66 SMN1; SMN2 (0.39) TSHRL3MBTL1MEN1KMT2AMAPT
SCHEMBL9645875 0.65 CA1 (0.43) TSHRL3MBTL1MEN1KMT2ATDP1
SCHEMBL30109225 0.65 KMT2A (0.42) TSHRL3MBTL1MEN1KMT2ATDP1
SCHEMBL2117227 0.65 KMT2A (0.42) TSHRL3MBTL1MEN1KMT2ATDP1
SCHEMBL12912993 0.64 NPC1 (0.44) L3MBTL1MEN1KMT2ATDP1GAA
SCHEMBL10485304 0.64 GAA (0.66) L3MBTL1MAPTGAAALDH1A1KDM4E

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-0284174-B1 THERAPEUTIC PREPARATIONS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-07-29 EP disclosed