SCHEMBL27255281

SCHEMBL27255281

c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4ccc(-c5ccccc5-c5ccc6oc7cc8ccccc8cc7c6c5)c5ccccc45)n3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.38
MAPK1 P28482 2/20 0.38
HSD17B10 Q99714 3/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
ALDH1A1 P00352 5/20 0.36
HPGD P15428 4/20 0.36
MAPT P10636 4/20 0.36
KDM4E B2RXH2 3/20 0.36
TSHR P16473 2/20 0.36
ALOX15 P16050 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
CYP1A1 P04798 1/20 0.35
CYP1B1 Q16678 1/20 0.35
MEN1 O00255 5/20 0.35
NTSR1 P30989 1/20 0.35
PLA2G2A P14555 2/20 0.34

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
SCHEMBL27254960 0.94 KMT2A (0.40) KMT2AMAPK1HSD17B10TP53CYP1A2
SCHEMBL27255285 0.90 KMT2A (0.40) KMT2AMAPK1HSD17B10TP53CYP1A2
SCHEMBL26750799 0.86 KDM4E (0.38) KMT2AMAPK1HSD17B10CYP1A2ALDH1A1
SCHEMBL27254959 0.84 ALOX5 (0.39) KMT2AMAPK1HSD17B10TP53CYP1A2
SCHEMBL27254958 0.84 HSD17B10 (0.37) KMT2AMAPK1HSD17B10TP53CYP1A2
SCHEMBL15501594 0.84 PLA2G2A (0.44) KMT2AMAPK1HSD17B10ALDH1A1HPGD
SCHEMBL27391952 0.83 KMT2A (0.40) KMT2AMAPK1HSD17B10TP53CYP1A2
SCHEMBL27454992 0.83 ALDH1A1 (0.44) KMT2AMAPK1HSD17B10TP53CYP1A2
SCHEMBL22161063 0.83 ALDH1A1 (0.40) KMT2AMAPK1HSD17B10TP53CYP1A2
SCHEMBL24184572 0.82 ALDH1A1 (0.37) KMT2AMAPK1HSD17B10TP53CYP1A2

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-2024024726-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2024-02-01 WO disclosed