SCHEMBL22707103

SCHEMBL22707103

Cc1nc2cccc(-c3c4cccc(-c5cccc6c5c5ccccc5n6-c5ccccc5)c4cc4c(-c5cccc6c5c5ccccc5n6-c5ccccc5)cccc34)c2n1-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.45
HTT P42858 1/20 0.45
HSD17B10 Q99714 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ALOX15 P16050 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HKDC1 Q2TB90 1/20 0.36
POLB P06746 3/20 0.36
NPC1 O15118 1/20 0.35
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
ALOX12 P18054 1/20 0.35
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL22706234 0.84 SMN1; SMN2 (0.42) MAPK1HTTHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL22706237 0.83 MAPK1 (0.48) MAPK1HTTHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL22706367 0.80 L3MBTL1 (0.45) MAPK1HSD17B10ALDH1A1KDM4EATM
SCHEMBL22707824 0.79 L3MBTL1 (0.46) MAPK1HSD17B10ALDH1A1KDM4EATM
SCHEMBL22705786 0.78 L3MBTL1 (0.42) MAPK1HSD17B10ALDH1A1KDM4EATM
SCHEMBL22706684 0.78 L3MBTL1 (0.45) HTTHSD17B10ALDH1A1KDM4EATM
SCHEMBL22705748 0.78 L3MBTL1 (0.45) HTTHSD17B10ALDH1A1KDM4EATM
SCHEMBL22705877 0.78 L3MBTL1 (0.45) MAPK1HSD17B10ALDH1A1KDM4EATM
SCHEMBL20334585 0.77 L3MBTL1 (0.47) HTTHSD17B10ALDH1A1KDM4EATM
SCHEMBL22706329 0.76 L3MBTL1 (0.46) HTTHSD17B10ALDH1A1KDM4EATM

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-20200373496-A1 ORGANIC LIGHT EMITTING ELEMENT LG CHEM, LTD. (KR) 2020-11-26 US disclosed