SCHEMBL23816656

SCHEMBL23816656

Clc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5ccccc5c34)n2)c2c1oc1ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.38
ALDH1A1 P00352 5/20 0.37
TSHR P16473 4/20 0.37
POLB P06746 3/20 0.37
HPGD P15428 3/20 0.37
KDM4E B2RXH2 3/20 0.37
PIM1 P11309 2/20 0.37
CSNK2A2 P19784 2/20 0.37
CSNK2B P67870 2/20 0.37
PIM3 Q86V86 2/20 0.37
PIM2 Q9P1W9 2/20 0.37
CDC14B O60729 1/20 0.37
CDC14A Q9UNH5 1/20 0.37
BACE1 P56817 1/20 0.37
NPSR1 Q6W5P4 2/20 0.37
LMNA P02545 4/20 0.36
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
GAA P10253 1/20 0.36
HSD17B10 Q99714 3/20 0.36

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
SCHEMBL21662930 0.95 MAPT (0.41) MAPTALDH1A1TSHRPOLBHPGD
SCHEMBL24657148 0.93 MAPT (0.40) MAPTALDH1A1TSHRPOLBHPGD
SCHEMBL23816535 0.92 MAPT (0.40) MAPTALDH1A1TSHRPOLBHPGD
SCHEMBL23816621 0.92 MAPT (0.40) MAPTALDH1A1TSHRPOLBHPGD
SCHEMBL23738695 0.92 AHR (0.35) MAPTALDH1A1TSHRPOLBHPGD
SCHEMBL21191829 0.91 AHR (0.43) MAPTALDH1A1TSHRPOLBHPGD
SCHEMBL23816402 0.91 ALDH1A1 (0.41) MAPTALDH1A1TSHRPOLBHPGD
SCHEMBL23450002 0.91 ALDH1A1 (0.41) MAPTALDH1A1TSHRPOLBHPGD
SCHEMBL23820573 0.90 BACE1 (0.38) MAPTALDH1A1TSHRPOLBHPGD
SCHEMBL24888153 0.90 MAPT (0.39) MAPTALDH1A1TSHRPOLBHPGD

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-2021182834-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-09-16 WO disclosed