SCHEMBL15463513

SCHEMBL15463513

COc1cccc(F)c1C1c2[nH]c3c(OC)cccc3c2C2(CC2)CN1C(C)=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MAPT P10636 3/20 0.36
GAA P10253 2/20 0.36
ALDH1A1 P00352 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KDM4E B2RXH2 2/20 0.36
POLB P06746 2/20 0.36
MCL1 Q07820 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
RECQL P46063 1/20 0.36
GLA P06280 1/20 0.36
HCRTR1 O43613 3/20 0.33
HCRTR2 O43614 3/20 0.33
THRB P10828 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
HHAT Q5VTY9 1/20 0.33

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
SCHEMBL2030476 0.87 ABCB1 (0.46) HPGDMEN1KMT2AMAPTGAA
SCHEMBL2031216 0.87 MAPT (0.35) HPGDMEN1KMT2AMAPTGAA
SCHEMBL2031985 0.86 LMNA (0.38) HPGDMEN1KMT2AMAPTGAA
SCHEMBL2031420 0.85 MAPKAPK2 (0.41) HPGDMAPTGAAALDH1A1L3MBTL1
SCHEMBL2034749 0.85 MAPKAPK2 (0.39) HPGDMAPTALDH1A1L3MBTL1KDM4E
SCHEMBL2034779 0.84 TP53 (0.41) MAPTSMN1; SMN2ABCB1ABCG2
SCHEMBL998363 0.82 KIF11 (0.42) HPGDMAPTALDH1A1L3MBTL1KDM4E
SCHEMBL2029023 0.81 STAT3 (0.38) HPGDMAPTALDH1A1KDM4EPOLB
SCHEMBL2030157 0.81 MAPT (0.37) MAPTALDH1A1SMN1; SMN2ABCB1ABCG2
SCHEMBL997940 0.80 KIF11 (0.44) MAPTALDH1A1SMN1; SMN2ABCB1ABCG2

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-1829874-B1 TRICYCLIC COMPOUND AND USE THEREOF ONO PHARMACEUTICAL CO (JP) 2014-02-12 EP claimed