SCHEMBL17033710

SCHEMBL17033710

c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)nc(-n4c5ccccc5c5cc6nc7c8ccccc8c8ccccc8n7c6cc54)n3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.40
HPGD P15428 7/20 0.40
ALDH1A1 P00352 6/20 0.40
KMT2A Q03164 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 5/20 0.36
LMNA P02545 4/20 0.36
POLB P06746 2/20 0.36
TP53 P04637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
DHODH Q02127 1/20 0.34
ACACA Q13085 1/20 0.33
L3MBTL1 Q9Y468 4/20 0.33
MAPK1 P28482 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
HTT P42858 2/20 0.33
ACHE P22303 1/20 0.33
MEN1 O00255 1/20 0.32
ADORA2A P29274 1/20 0.31
GLA P06280 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
SCHEMBL17033683 0.91 ALDH1A1 (0.46) KDM4EHPGDALDH1A1KMT2ASMN1; SMN2
SCHEMBL16067107 0.90 KDM4E (0.45) KDM4EHPGDALDH1A1KMT2ASMN1; SMN2
SCHEMBL17033707 0.90 HPGD (0.41) KDM4EHPGDALDH1A1KMT2ASMN1; SMN2
SCHEMBL17033685 0.89 DHODH (0.38) KDM4EHPGDALDH1A1KMT2ASMN1; SMN2
SCHEMBL16066964 0.89 KDM4E (0.46) KDM4EHPGDALDH1A1KMT2ASMN1; SMN2
SCHEMBL16066506 0.87 KDM4E (0.47) KDM4EHPGDALDH1A1KMT2ASMN1; SMN2
SCHEMBL17033763 0.87 KDM4E (0.43) KDM4EHPGDALDH1A1KMT2ASMN1; SMN2
SCHEMBL17033701 0.87 HPGD (0.39) KDM4EHPGDALDH1A1KMT2ASMN1; SMN2
SCHEMBL16066296 0.86 KDM4E (0.48) KDM4EHPGDALDH1A1KMT2ASMN1; SMN2
SCHEMBL17033666 0.86 MAPT (0.39) KDM4EHPGDALDH1A1KMT2ASMN1; SMN2

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
WO-2015125986-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 WO disclosed