SCHEMBL16416043

SCHEMBL16416043

Clc1ccc2c(c1)c1ccc3c(cnn3-c3ccccc3)c1n2-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM1 Q13255 2/20 0.43
▸ GRM5 P41594 1/20 0.43
▸ KMT2A Q03164 6/20 0.42
▸ MEN1 O00255 4/20 0.42
▸ LMNA P02545 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ MAT2A P31153 5/20 0.41
▸ MAPT P10636 3/20 0.40
▸ NPC1 O15118 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ PRMT5 O14744 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ HPGD P15428 3/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ HTT P42858 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ TP53 P04637 2/20 0.38

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
SCHEMBL19031819 0.88 GRM1 (0.47) GRM1GRM5KMT2AMEN1LMNA
SCHEMBL19031795 0.87 NPC1 (0.44) GRM1GRM5KMT2AMEN1LMNA
SCHEMBL16424970 0.86 NR3C1 (0.44) KMT2AMEN1LMNAL3MBTL1MAPT
SCHEMBL15811055 0.84 GRM1 (0.43) GRM1KMT2AMEN1LMNAL3MBTL1
SCHEMBL16425027 0.81 KDM4E (0.45) GRM1LMNAL3MBTL1MAPTALDH1A1
SCHEMBL18627660 0.79 L3MBTL1 (0.44) KMT2AMEN1LMNAL3MBTL1MAT2A
SCHEMBL15811437 0.78 NR3C1 (0.43) KMT2ALMNAMAPTNPC1RAB9A
SCHEMBL16425008 0.78 NR3C1 (0.43) LMNAL3MBTL1MAPTALDH1A1KDM4E
SCHEMBL15811202 0.77 NR3C1 (0.44) GRM1LMNAL3MBTL1MAPTALDH1A1
SCHEMBL15811054 0.77 NR3C1 (0.42) LMNAMAPTALDH1A1HTTTP53

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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