SCHEMBL7199508

SCHEMBL7199508

O=Cc1cccc2c1CNC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
BLM P54132 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CD44 P16070 2/20 0.39
ERN1 O75460 2/20 0.36
PNMT P11086 2/20 0.35
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
TRIM24 O15164 1/20 0.34
TRIM33 Q9UPN9 1/20 0.34
OXTR P30559 1/20 0.34
DYRK2 Q92630 3/20 0.33
IKBKB O14920 2/20 0.33
RAF1 P04049 1/20 0.33
RPS6KB1 P23443 1/20 0.33
MAPK1 P28482 1/20 0.33
AKT1 P31749 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
SCHEMBL28779140 0.98 LMNA (0.39) LMNAKMT2AMEN1THRBBLM
Hydrochloric Acid SCHEMBL29951826 0.98 LMNA (0.39) LMNAKMT2AMEN1THRBBLM
Hydrochloric Acid SCHEMBL29168703 0.98 LMNA (0.39) LMNAKMT2AMEN1THRBBLM
SCHEMBL10974814 0.84 PRCP (0.41) LMNAKMT2AMEN1THRBBLM
SCHEMBL2553918 0.83 CD44 (0.56) LMNAKMT2AMEN1THRBBLM
SCHEMBL29935954 0.83 CD44 (0.56) LMNAKMT2AMEN1THRBBLM
SCHEMBL19708906 0.83 PNMT (0.56) CD44PNMTMAOBPRCP
Hydrochloric Acid SCHEMBL14686001 0.82 CD44 (0.54) LMNAKMT2AMEN1THRBBLM
SCHEMBL629055 0.80 CD44 (0.39) CD44PNMTALDH1A1OXTRDYRK2
SCHEMBL27523831 0.72 MEN1 (0.37) LMNAKMT2AMEN1THRBBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023002165-A1 INHIBITOR COMPOUNDS Neophore Limited (GB) 2023-01-26 WO disclosed
EP-1363900-A1 ISOINDOLE-IMIDE COMPOUNDS AS TNF-INHIBITORS CELGENE CORPORATION (US) 2003-11-26 EP disclosed
WO-2002059106-A1 ISOINDOLE-IMIDE COMPOUNDS, COMPOSITIONS, AND USES THEREOF CELGENE CORPORATION (US) 2002-08-01 WO disclosed