SCHEMBL4429019

SCHEMBL4429019

CC(C)(C(=O)O)c1cccc(NC(=O)C(=O)c2c(-c3ccccc3)cc3ccccn23)c1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.61
ALDH1A1 P00352 7/20 0.61
SMN1; SMN2 Q16637 4/20 0.61
LMNA P02545 3/20 0.61
THRB P10828 1/20 0.57
HTT P42858 3/20 0.57
L3MBTL1 Q9Y468 4/20 0.54
KMT2A Q03164 4/20 0.45
TDP1 Q9NUW8 2/20 0.45
KDM4E B2RXH2 3/20 0.43
RAB9A P51151 3/20 0.43
MEN1 O00255 3/20 0.41
RECQL P46063 1/20 0.41
NPC1 O15118 1/20 0.37
MAPK1 P28482 1/20 0.36

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
SCHEMBL1645452 0.88 MAPT (0.60) MAPTALDH1A1SMN1; SMN2LMNATHRB
SCHEMBL1645548 0.87 MAPT (0.58) MAPTALDH1A1SMN1; SMN2LMNATHRB
SCHEMBL1644750 0.84 L3MBTL1 (0.69) MAPTALDH1A1SMN1; SMN2LMNATHRB
SCHEMBL1647401 0.84 MAPT (0.66) MAPTALDH1A1SMN1; SMN2LMNATHRB
SCHEMBL1647257 0.83 MAPT (0.65) MAPTALDH1A1SMN1; SMN2LMNATHRB
SCHEMBL1647290 0.83 MAPT (0.64) MAPTALDH1A1SMN1; SMN2LMNATHRB
SCHEMBL1645601 0.82 ALDH1A1 (0.63) MAPTALDH1A1SMN1; SMN2LMNATHRB
SCHEMBL3890801 0.82 MAPT (0.63) MAPTALDH1A1SMN1; SMN2LMNATHRB
SCHEMBL1644516 0.81 ALDH1A1 (0.63) MAPTALDH1A1SMN1; SMN2LMNATHRB
SCHEMBL1646034 0.80 ALDH1A1 (0.62) MAPTALDH1A1SMN1; SMN2LMNATHRB

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