SCHEMBL25974342

SCHEMBL25974342

c1ccc(-c2nc(-c3cccc4oc5cc(-c6ccc7ccccc7c6)ccc5c34)nc3c2oc2ccccc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.38
ALDH1A1 P00352 5/20 0.38
CYP1A2 P05177 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
TSHR P16473 3/20 0.37
KDM4E B2RXH2 3/20 0.37
POLB P06746 2/20 0.37
HPGD P15428 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
LMNA P02545 4/20 0.36
KMT2A Q03164 4/20 0.36
HSD17B10 Q99714 2/20 0.36
USP2 O75604 1/20 0.36
HTT P42858 1/20 0.36
TERT O14746 1/20 0.35
HCRTR1 O43613 1/20 0.35
MEN1 O00255 3/20 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
SCHEMBL25974352 0.99 MAPT (0.37) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL25974354 0.99 MAPT (0.37) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL25974355 0.97 MAPT (0.37) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL25974341 0.94 MAPT (0.40) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL25974557 0.93 MAPT (0.41) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL25974573 0.93 MAPT (0.39) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL25974567 0.93 MAPT (0.39) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL25974350 0.93 NPC1 (0.36) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL25974357 0.93 CYP1A2 (0.40) MAPTALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL25974805 0.92 MAPT (0.37) MAPTALDH1A1CYP1A2CYP2C9CYP2C19

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-2023149718-A1 ORGANIC LIGHT-EMITTING ELEMENT INCLUDING HETEROCYCLIC COMPOUND, COMPOSITION FOR ORGANIC MATERIAL LAYER OF ORGANIC LIGHT-EMITTING ELEMENT, AND METHOD FOR MANUFACTURING ORGANIC LIGHT-EMITTING ELEMENT 엘티소재주식회사 2023-08-10 WO disclosed