SCHEMBL16066176

SCHEMBL16066176

Fc1ccc(-c2cc(-c3ccc(F)cc3)nc(-n3c4ccccc4c4ccc5c6ccccc6c6nc7ccccc7n6c5c43)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
HPGD P15428 6/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
KMT2A Q03164 2/20 0.51
CYP19A1 P11511 1/20 0.40
KDM4E B2RXH2 6/20 0.40
MAPT P10636 3/20 0.40
HSD17B10 Q99714 2/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
HTT P42858 2/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
ACP1 P24666 1/20 0.35
FLT3 P36888 2/20 0.35
MEN1 O00255 1/20 0.35

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
SCHEMBL16066129 0.91 KDM4E (0.46) ALDH1A1HPGDSMN1; SMN2KMT2AKDM4E
SCHEMBL16066373 0.91 KDM4E (0.48) ALDH1A1HPGDSMN1; SMN2KMT2AKDM4E
SCHEMBL16066667 0.90 ALDH1A1 (0.47) ALDH1A1HPGDSMN1; SMN2KMT2ACYP19A1
SCHEMBL16066602 0.89 ALDH1A1 (0.48) ALDH1A1HPGDSMN1; SMN2KMT2ACYP19A1
SCHEMBL16066476 0.89 ALDH1A1 (0.48) ALDH1A1HPGDSMN1; SMN2KMT2ACYP19A1
SCHEMBL16066159 0.87 DHODH (0.41) ALDH1A1HPGDSMN1; SMN2KMT2AKDM4E
SCHEMBL16066182 0.87 KDM4E (0.41) ALDH1A1HPGDSMN1; SMN2KMT2AKDM4E
SCHEMBL16066947 0.87 ALDH1A1 (0.51) ALDH1A1HPGDSMN1; SMN2KMT2ACYP19A1
SCHEMBL22649232 0.86 KDM4E (0.50) ALDH1A1HPGDSMN1; SMN2KMT2AKDM4E
SCHEMBL16067119 0.86 ALDH1A1 (0.50) ALDH1A1HPGDSMN1; SMN2KMT2ACYP19A1

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-2014142488-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT INCLUDING SAME 주식회사 두산 (KR) 2014-09-18 WO disclosed