SCHEMBL25146972

SCHEMBL25146972

c1ccc(-c2nc(-c3ccccc3)c3oc4ccc5c6ccccc6n(-c6ccc7c8ccccc8c8ccccc8c7c6)c5c4c3n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.35
ALDH1A1 P00352 7/20 0.35
TSHR P16473 5/20 0.35
HPGD P15428 2/20 0.35
LMNA P02545 5/20 0.33
KDM4E B2RXH2 3/20 0.33
HSD17B10 Q99714 3/20 0.33
MAPK1 P28482 2/20 0.33
POLB P06746 3/20 0.33
KMT2A Q03164 6/20 0.32
MEN1 O00255 5/20 0.32
NPSR1 Q6W5P4 3/20 0.32
USP2 O75604 1/20 0.32
HTT P42858 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
GAA P10253 2/20 0.31
ATM Q13315 1/20 0.30

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
SCHEMBL25147209 0.92 KMT2A (0.36) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL25146952 0.91 MAPT (0.34) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL20024220 0.89 MAPT (0.39) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL25146986 0.88 ALDH1A1 (0.35) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL20024224 0.88 MAPT (0.39) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL25146970 0.87 MAPT (0.32) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL25146930 0.87 MAPT (0.37) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL25146789 0.87 MAPT (0.39) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL24278937 0.86 MAPT (0.41) MAPTALDH1A1TSHRHPGDLMNA
SCHEMBL25147366 0.85 KMT2A (0.36) MAPTALDH1A1TSHRHPGDLMNA

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-2023061998-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-04-20 WO disclosed