SCHEMBL19986125

SCHEMBL19986125

c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4c5c6ccccc6c6ccccc6c5c5c6ccccc6oc5c43)c2)cc1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HSD17B10 Q99714 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CYP3A4 P08684 1/20 0.32
ALPI P09923 1/20 0.32
GAA P10253 1/20 0.32
PKM P14618 1/20 0.32
HPGD P15428 1/20 0.32
CASP3 P42574 1/20 0.32
RECQL P46063 1/20 0.32
BLM P54132 1/20 0.32
CASP7 P55210 1/20 0.32
CASP6 P55212 1/20 0.32
MCL1 Q07820 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ACHE P22303 1/20 0.32

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
SCHEMBL19986126 0.99 MEN1 (0.32) MAPTMEN1KMT2AHSD17B10NPC1
SCHEMBL19986124 0.95 PLA2G2A (0.31) MAPTMEN1KMT2AHSD17B10NPC1
SCHEMBL19986127 0.86 MEN1 (0.32) MAPTMEN1KMT2AHSD17B10KDM4E
SCHEMBL19986123 0.86 ADORA2A (0.33) MAPTMEN1KMT2AHSD17B10NPC1
SCHEMBL19986201 0.85 ADORA2A (0.34) MAPTMEN1KMT2AHSD17B10NPC1
SCHEMBL19863075 0.84 KDM4E (0.34) MAPTMEN1KMT2AHSD17B10KDM4E
SCHEMBL17405624 0.83 MAPT (0.43) MAPTMEN1KMT2AHSD17B10KDM4E
SCHEMBL19863072 0.83 MAPT (0.34) MAPTMEN1KMT2AHSD17B10KDM4E
SCHEMBL19986200 0.83 PLA2G2A (0.32) MAPTMEN1KMT2AACHECSF1R
SCHEMBL19986136 0.83 EGFR (0.40) MAPTHSD17B10NPC1RAB9AKDM4E

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-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed