SCHEMBL24808798

SCHEMBL24808798

Nc1cc(Br)cc2cc(Br)ccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48
KMT2A Q03164 1/20 0.48
BACE1 P56817 2/20 0.42
CYP2A6 P11509 2/20 0.41
PDPK1 O15530 2/20 0.41
JAK2 O60674 2/20 0.41
IDO1 P14902 1/20 0.39
TDO2 P48775 1/20 0.39
CHEK1 O14757 1/20 0.38
GLA P06280 1/20 0.38
HTT P42858 1/20 0.37
PLAU P00749 1/20 0.37
PABPC1 P11940 1/20 0.36
ERN1 O75460 1/20 0.36
ALOX15 P16050 1/20 0.36
MAPK1 P28482 1/20 0.36
ACHE P22303 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
SCHEMBL9485022 0.83 ALDH1A1 (0.52) KDM4EALDH1A1MEN1MAPTKMT2A
SCHEMBL1429141 0.79 ALDH1A1 (0.50) KDM4EALDH1A1MEN1MAPTKMT2A
SCHEMBL4074869 0.77 ALDH1A1 (0.54) KDM4EALDH1A1MEN1MAPTKMT2A
Hydrochloric Acid SCHEMBL19462883 0.77 HPRT1 (0.41) KDM4EALDH1A1MEN1MAPTKMT2A
SCHEMBL11213754 0.76 CYP2A6 (0.46) KDM4EALDH1A1MEN1MAPTKMT2A
SCHEMBL28253602 0.75 CYP2A6 (0.44) KDM4EALDH1A1MEN1MAPTKMT2A
SCHEMBL2067129 0.73 MAPT (0.50) KDM4EALDH1A1MEN1MAPTKMT2A
SCHEMBL30274387 0.73 MAPT (0.50) KDM4EALDH1A1MEN1MAPTKMT2A
SCHEMBL6126980 0.73 KDM4E (0.50) KDM4EALDH1A1MEN1MAPTKMT2A
SCHEMBL30368680 0.73 KDM4E (0.50) KDM4EALDH1A1MEN1MAPTKMT2A

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-2022267941-A1 ORGANOMETALLIC IRIDIUM COMPOUND 广东阿格蕾雅光电材料有限公司 2022-12-29 WO disclosed