SCHEMBL4594468

SCHEMBL4594468

NC(=O)c1c(-c2ccccc2Cl)ccc2c1C(=O)c1ccccc1-2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.44
MAPT P10636 4/20 0.44
ALDH1A1 P00352 3/20 0.44
LMNA P02545 3/20 0.44
PTPRC P08575 2/20 0.44
ADORA2A P29274 2/20 0.44
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
TTR P02766 1/20 0.42
GRK6 P43250 1/20 0.42
FGFR1 P11362 1/20 0.41
SRC P12931 1/20 0.41
FGFR2 P21802 1/20 0.41
FGFR4 P22455 1/20 0.41
FGFR3 P22607 1/20 0.41
HSP90AA1 P07900 2/20 0.40
HSP90AB1 P08238 2/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
POLB P06746 2/20 0.40

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
SCHEMBL4585591 0.81 PTPRC (0.46) MAPTALDH1A1LMNAPTPRCADORA2A
SCHEMBL11310500 0.79 MAPT (0.45) HSD17B10MAPTALDH1A1LMNAPTPRC
SCHEMBL19299398 0.79 PTPRC (0.55) MAPTALDH1A1LMNAPTPRCADORA2A
SCHEMBL4594474 0.77 MAPT (0.51) MAPTALDH1A1PTPRCADORA2AKEAP1
SCHEMBL18526807 0.73 HSD17B10 (0.47) HSD17B10MAPTALDH1A1KMT2AIKBKB
SCHEMBL10500642 0.73 KEAP1 (0.62) HSD17B10MAPTALDH1A1LMNAADORA2A
SCHEMBL8671883 0.73 ADORA2A (0.57) MAPTALDH1A1LMNAPTPRCADORA2A
SCHEMBL5617186 0.72 GRK6 (0.62) MAPTALDH1A1LMNAADORA2AKEAP1
SCHEMBL27925971 0.71 KEAP1 (0.59) HSD17B10MAPTALDH1A1LMNAKEAP1
SCHEMBL7829487 0.70 KEAP1 (0.73) MAPTALDH1A1LMNAKEAP1NFE2L2

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
EP-1804786-A4 SUBSTITUTED N-ARYL-9-OXO-9H-FLUORENE-1-CARBOXAMIDES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS CYTOVIA INC (US) 2008-01-02 EP claimed
EP-1804786-A2 SUBSTITUTED N-ARYL-9-OXO-9H-FLUORENE-1-CARBOXAMIDES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS Cytovia, Inc. (US) 2007-07-11 EP claimed
WO-2006039356-A2 SUBSTITUTED N-ARYL-9-OXO-9H-FLUORENE-1-CARBOXAMIDES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS CYTOVIA, INC. (US) 2006-04-13 WO claimed