SCHEMBL16415953

SCHEMBL16415953

O=[N+]([O-])c1ccc(Cl)cc1-c1ccc2c(cnn2-c2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 10/20 0.46
▸ PGR P06401 3/20 0.45
▸ RAB9A P51151 5/20 0.43
▸ MAPT P10636 4/20 0.43
▸ NPC1 O15118 4/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ PKM P14618 1/20 0.40
▸ AR P10275 1/20 0.40
▸ HPGD P15428 2/20 0.40
▸ HSD11B1 P28845 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ NFKB2 Q00653 1/20 0.40
▸ RELA Q04206 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ ATM Q13315 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
SCHEMBL16416085 0.91 RAB9A (0.47) NR3C1PGRRAB9AMAPTNPC1
SCHEMBL15797007 0.87 NR3C1 (0.52) NR3C1PGRRAB9AMAPTNPC1
SCHEMBL15797029 0.87 NR3C1 (0.46) NR3C1PGRRAB9AMAPTNPC1
SCHEMBL15796896 0.80 BIRC5 (0.42) RAB9AMAPTNPC1HPGDHSD11B1
SCHEMBL15797001 0.78 KHK (0.51) NR3C1PGRRAB9AMAPTNPC1
SCHEMBL15797005 0.78 KHK (0.46) NR3C1PGRRAB9AMAPTNPC1
SCHEMBL16671215 0.75 L3MBTL1 (0.42) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL25941799 0.73 ALDH1A1 (0.58) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL9261807 0.73 ALDH1A1 (0.61) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL24221899 0.73 MAPT (0.57) RAB9AMAPTNPC1MEN1KMT2A

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
WO-2015012528-A2 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 (KR) 2015-01-29 — — WO disclosed
WO-2015012528-A2 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 (KR) 2015-01-29 — — WO disclosed
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