SCHEMBL24029728

SCHEMBL24029728

c1ccc(-c2ccc(-c3ccc(N(c4ccc5c(ccc6ccccc65)c4)c4ccc5c6ccccc6c6ccccc6c5c4)cc3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 4/20 0.45
ALDH1A1 P00352 3/20 0.42
HSD17B10 Q99714 2/20 0.42
CYP1B1 Q16678 2/20 0.42
HIF1A Q16665 1/20 0.42
CYP2A6 P11509 1/20 0.39
TSHR P16473 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CYP1A2 P05177 3/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
SOS1 Q07889 1/20 0.36
ERBB2 P04626 1/20 0.36
FYN P06241 1/20 0.36
MAOA P21397 1/20 0.36
ACHE P22303 1/20 0.36
AHR P35869 1/20 0.36
MAPT P10636 2/20 0.36
CYP1A1 P04798 1/20 0.36
HPGD P15428 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
SCHEMBL24029722 1.00 HPRT1 (0.45) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL26054259 0.97 ALDH1A1 (0.47) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL26054861 0.97 ALDH1A1 (0.47) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL26054858 0.97 HPRT1 (0.48) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL24372522 0.97 HPRT1 (0.48) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL24029416 0.95 HPRT1 (0.44) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL26054860 0.95 HPRT1 (0.47) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL26054798 0.95 HPRT1 (0.47) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL26851472 0.95 HPRT1 (0.47) HPRT1ALDH1A1HSD17B10CYP1B1HIF1A
SCHEMBL24029683 0.95 HPRT1 (0.47) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021261907-A1 ORGANIC LIGHT EMITTING DEVICE 주식회사 엘지화학 2021-12-30 WO disclosed
WO-2021230715-A1 ORGANIC LIGHT-EMITTING ELEMENT 주식회사 엘지화학 2021-11-18 WO disclosed