SCHEMBL17899162

SCHEMBL17899162

c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc(-c3ccc4oc5ccccc5c4c3)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.40
KMT2A Q03164 8/20 0.40
MEN1 O00255 7/20 0.40
ALDH1A1 P00352 7/20 0.40
HPGD P15428 7/20 0.40
NTSR1 P30989 1/20 0.40
KDM4E B2RXH2 6/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
LMNA P02545 2/20 0.39
GLA P06280 1/20 0.39
CHEK2 O96017 1/20 0.38
MAPK1 P28482 2/20 0.36
PTPN1 P18031 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL16185396 1.00 MAPT (0.40) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL16185671 0.98 KDM4E (0.41) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL16185646 0.97 MEN1 (0.40) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL16185448 0.97 MEN1 (0.40) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL9881127 0.96 MAPT (0.40) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL16185474 0.96 MAPT (0.40) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL16185420 0.96 MAPT (0.40) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL16185525 0.96 MAPT (0.40) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL16185423 0.96 MAPT (0.40) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL16185452 0.96 CHEK2 (0.40) MAPTKMT2AMEN1ALDH1A1HPGD

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
US-20160197289-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-07-07 US disclosed
US-20160197289-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-07-07 US disclosed