SCHEMBL26047772

SCHEMBL26047772

c1ccc2cc(-c3ccc(-c4nc(-c5ccc6oc7ccccc7c6c5)nc(-c5cccc6c5ccc5c7ccccc7ccc65)n4)cc3)ccc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.38
KDM4E B2RXH2 6/20 0.38
ALDH1A1 P00352 5/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
ESR1 P03372 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 3/20 0.38
HSD17B10 Q99714 3/20 0.38
TSHR P16473 2/20 0.38
ALOX15 P16050 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
GLA P06280 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP1A1 P04798 1/20 0.36
CYP1B1 Q16678 1/20 0.36
CASP3 P42574 1/20 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
SCHEMBL23759261 0.96 MAPT (0.40) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL24306924 0.96 MAPT (0.40) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL26260479 0.91 CASP3 (0.38) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL26047395 0.91 KDM4E (0.40) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL23759551 0.91 KDM4E (0.45) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL24472871 0.91 KDM4E (0.45) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL26271157 0.91 ALDH1A1 (0.40) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL26271462 0.90 HCRTR1 (0.40) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL26271443 0.90 HCRTR1 (0.40) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL23759552 0.90 CYP1A1 (0.39) MAPTKDM4EALDH1A1KMT2AMEN1

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-2023153905-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2023-08-17 WO disclosed