SCHEMBL7479042

SCHEMBL7479042

Cc1c[nH]c(-c2cccc(NC(=O)c3cccc4c3Cc3ccccc3-4)c2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
PPARG P37231 1/20 0.42
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
TP53 P04637 4/20 0.42
MAPT P10636 2/20 0.42
OPRL1 P41146 1/20 0.42
HTT P42858 2/20 0.42
NR2E3 Q9Y5X4 1/20 0.41
KDM4E B2RXH2 5/20 0.41
MAPK1 P28482 1/20 0.41
GAA P10253 1/20 0.40
ALDH1A1 P00352 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
CNR1 P21554 1/20 0.39
POLB P06746 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL6803374 0.78 PPARG (0.45) L3MBTL1PPARGCYP2C9TSHRTP53
SCHEMBL6802789 0.77 CNR1 (0.47) L3MBTL1PPARGCYP2C9TSHRHTT
SCHEMBL6804905 0.76 KDM4E (0.54) PPARGCYP2C9TSHRKDM4EALDH1A1
SCHEMBL6808746 0.76 ROCK2 (0.48) L3MBTL1PPARGCYP2C9TSHRHTT
SCHEMBL6799418 0.76 PPARG (0.45) L3MBTL1PPARGCYP2C9TSHRHTT
SCHEMBL6628576 0.76 CYP2C9 (0.56) PPARGCYP2C9TSHRTP53HTT
SCHEMBL6804264 0.75 NR2E1 (0.52) L3MBTL1PPARGCYP2C9TSHRNPC1
SCHEMBL7476515 0.75 MAPT (0.49) TP53MAPTNR2E3KDM4EALDH1A1
SCHEMBL678882 0.73 ALDH1A1 (0.59) PPARGCYP2C9TSHRHTTALDH1A1
SCHEMBL6759795 0.72 CYP2C9 (0.50) L3MBTL1PPARGCYP2C9TSHRTP53

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1216240-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-06-26 EP disclosed
WO-2001025229-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-04-12 WO disclosed