SCHEMBL17864152

SCHEMBL17864152

c1ccc(-c2cc(-c3cccc(-n4c5ccccc5c5ccc6c7ccc8ccccc8c7ccc6c54)c3)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.39
KMT2A Q03164 6/20 0.39
MAPT P10636 5/20 0.39
HPGD P15428 5/20 0.39
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 4/20 0.39
LMNA P02545 3/20 0.39
GLA P06280 1/20 0.39
NTSR1 P30989 1/20 0.38
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
NPC1 O15118 1/20 0.35
RECQL P46063 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP1A1 P04798 1/20 0.35
CYP1B1 Q16678 1/20 0.35
GAA P10253 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
SCHEMBL23763293 0.96 MEN1 (0.40) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL17864149 0.96 MEN1 (0.40) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL17864158 0.93 MEN1 (0.36) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL17864147 0.91 KDM4E (0.39) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL17864153 0.91 KDM4E (0.36) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL9883258 0.90 KDM4E (0.44) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL17864168 0.90 ALDH1A1 (0.36) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL22596480 0.89 MEN1 (0.39) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL18996038 0.88 MEN1 (0.38) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL24163305 0.88 MEN1 (0.44) MEN1KMT2AMAPTHPGDALDH1A1

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-2016099037-A2 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2016-06-23 WO disclosed