SCHEMBL26054873

SCHEMBL26054873

c1ccc(N(c2ccc3c(ccc4c5ccccc5ccc34)c2)c2cc3ccccc3c3ccccc23)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 4/20 0.47
ALDH1A1 P00352 4/20 0.44
HSD17B10 Q99714 3/20 0.44
CYP1B1 Q16678 2/20 0.44
HIF1A Q16665 1/20 0.44
CYP2A6 P11509 1/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP1A2 P05177 4/20 0.37
ERBB2 P04626 1/20 0.37
FYN P06241 1/20 0.37
MAOA P21397 1/20 0.37
ACHE P22303 1/20 0.37
AHR P35869 1/20 0.37
HPGD P15428 2/20 0.37
CYP1A1 P04798 1/20 0.37
MAPT P10636 1/20 0.37
PAX8 Q06710 1/20 0.36
TRPM4 Q8TD43 1/20 0.36
AKR1B1 P15121 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
SCHEMBL14070178 0.98 HPRT1 (0.43) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL26054282 0.95 ALDH1A1 (0.47) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL24655185 0.94 HPRT1 (0.41) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL14070180 0.94 HPRT1 (0.41) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL26852929 0.93 HPRT1 (0.47) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL24154463 0.93 ALDH1A1 (0.39) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL9889005 0.93 ALDH1A1 (0.39) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL14515926 0.92 ALDH1A1 (0.38) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL23821473 0.92 HPRT1 (0.48) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL14069628 0.91 TRPM4 (0.42) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A

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
EP-4235829-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-08-30 EP disclosed