SCHEMBL16367116

SCHEMBL16367116

C=C(/C=C\C(=C/C)c1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1)n1c2ccccc2c2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 5/20 0.37
▸ ALDH1A1 P00352 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ PER2 O15055 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ CRY1 Q16526 1/20 0.31
▸ CRY2 Q49AN0 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL20686844 0.84 SIGMAR1 (0.39) SIGMAR1ALDH1A1KMT2AMEN1
SCHEMBL17371450 0.84 SIGMAR1 (0.44) SIGMAR1ALDH1A1KMT2A
SCHEMBL22961695 0.75 L3MBTL1 (0.42) ALDH1A1KMT2AMEN1MAPTHPGD
SCHEMBL22593130 0.75 SIGMAR1 (0.34) SIGMAR1ALDH1A1KMT2A
SCHEMBL13175294 0.74 KMT2A (0.35) SIGMAR1ALDH1A1KMT2AMEN1MAPT
SCHEMBL20405379 0.73 SIGMAR1 (0.44) SIGMAR1ALDH1A1KMT2A
SCHEMBL23450684 0.71 L3MBTL1 (0.50) SIGMAR1ALDH1A1KMT2AMEN1PER2
SCHEMBL10160419 0.70 SIGMAR1 (0.43) SIGMAR1ALDH1A1KMT2AMEN1MAPT
SCHEMBL21974041 0.70 TSPO (0.35) SIGMAR1ALDH1A1KMT2A
SCHEMBL16743661 0.70 KDM4E (0.42) ALDH1A1MAPTHPGDHTTNPSR1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140374722-A1 COMPOUND, ORGANIC ELECTRIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2014-12-25 — — US disclosed
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