SCHEMBL4432353

SCHEMBL4432353

Cc1cccc2cc(-c3ccccc3)c(C(=O)C(N)=O)n12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
THRB P10828 1/20 0.41
MAPT P10636 6/20 0.40
MEN1 O00255 2/20 0.40
RECQL P46063 2/20 0.40
KMT2A Q03164 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
KDM4E B2RXH2 2/20 0.40
PLEC Q15149 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
HTT P42858 2/20 0.37
ALDH1A1 P00352 3/20 0.35
BCAT2 O15382 1/20 0.35
PLA2G10 O15496 2/20 0.34
PLA2G2A P14555 2/20 0.34
PLA2G1B P04054 1/20 0.34
PLA2G5 P39877 1/20 0.34
LMNA P02545 2/20 0.34
SCN9A Q15858 2/20 0.34
POLB P06746 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
SCHEMBL1645335 0.87 SMN1; SMN2 (0.45) SMN1; SMN2THRBMAPTMEN1RECQL
SCHEMBL3884110 0.86 SMN1; SMN2 (0.44) SMN1; SMN2THRBMAPTMEN1RECQL
SCHEMBL4440012 0.86 SMN1; SMN2 (0.44) SMN1; SMN2THRBMAPTMEN1RECQL
SCHEMBL1646251 0.82 L3MBTL1 (0.50) SMN1; SMN2THRBMAPTMEN1RECQL
SCHEMBL1644577 0.79 LMNA (0.46) SMN1; SMN2THRBMAPTMEN1KMT2A
SCHEMBL1646576 0.78 SMN1; SMN2 (0.40) SMN1; SMN2THRBMAPTMEN1RECQL
SCHEMBL1646671 0.78 SMN1; SMN2 (0.40) SMN1; SMN2THRBMAPTMEN1RECQL
SCHEMBL29697806 0.78 MMP1 (0.41) SMN1; SMN2THRBKDM4EALDH1A1BCAT2
SCHEMBL1645505 0.77 SMN1; SMN2 (0.39) SMN1; SMN2THRBMAPTMEN1RECQL
SCHEMBL1645503 0.77 SMN1; SMN2 (0.39) SMN1; SMN2THRBMAPTMEN1RECQL

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-2097413-A1 2-[(2-SUBSTITUTED)-IND0LIZIN-3-YL]-2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS F2G Limited (GB) 2009-09-09 EP disclosed
WO-2008062182-A1 2- [ (2-SUBSTITUTED) -IND0LIZIN-3-YL] -2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS F2G LTD (GB) 2008-05-29 WO disclosed