SCHEMBL27643153

SCHEMBL27643153

O=C(c1ccccc1)C1Nc2ccccc2N1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.46
ALOX15 P16050 3/20 0.46
MEN1 O00255 3/20 0.46
HPGD P15428 3/20 0.46
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 2/20 0.46
MAPK1 P28482 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TP53 P04637 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
HTT P42858 1/20 0.45
HBB P68871 1/20 0.45
CES1 P23141 4/20 0.44
CES2 O00748 2/20 0.44
TSHR P16473 2/20 0.44
DAO P14920 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
EPHX1 P07099 1/20 0.44

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
SCHEMBL31317542 0.85 TNKS2 (0.51) MAPTALOX15MEN1HPGDKMT2A
SCHEMBL3044369 0.78 MAPT (0.50) MAPTALOX15MEN1HPGDKMT2A
SCHEMBL27404564 0.75 MAPT (0.42) MAPTALOX15MEN1HPGDKMT2A
SCHEMBL17926008 0.72 MAPT (0.42) MAPTALOX15ALDH1A1NPC1HTT
SCHEMBL16716394 0.71 GAA (0.47) MAPTALOX15MEN1HPGDKMT2A
SCHEMBL13092132 0.71 MAPT (0.48) MAPTALOX15ALDH1A1KDM4ENPC1
SCHEMBL4781724 0.68 MAPT (0.50) MAPTALOX15ALDH1A1SMN1; SMN2NPC1
SCHEMBL6567240 0.68 MAPT (0.45) MAPTALOX15ALDH1A1HTTHBB
SCHEMBL18428493 0.67 HTR2A (0.56) MEN1KMT2AALDH1A1MCL1
SCHEMBL10942440 0.67 EPHX1 (0.69) MAPTALOX15MEN1HPGDKMT2A

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
CN-100415759-C Complex metal compound, material for organic electroluminescent element, material for luminescent coating film formation, and organic electroluminescent element IDEMITSU KOSAN CO (JP) 2008-09-03 CN disclosed
CN-1852910-A Complex metal compound, material for organic electroluminescent element, material for luminescent coating film formation, and organic electroluminescent element IDEMITSU KOSAN CO (JP) 2006-10-25 CN disclosed