SCHEMBL29134573

SCHEMBL29134573

Clc1cccc2ccc(C(Br)(Br)Br)c(Br)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.39
KMT2A Q03164 6/20 0.39
ALDH1A1 P00352 4/20 0.39
HSD17B10 Q99714 4/20 0.39
TSHR P16473 4/20 0.39
KDM4E B2RXH2 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
CYP1A2 P05177 4/20 0.37
HPGD P15428 2/20 0.37
CYP1A1 P04798 2/20 0.37
CYP1B1 Q16678 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2A6 P11509 2/20 0.34
MAPK1 P28482 3/20 0.33
GAA P10253 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MAPT P10636 2/20 0.33
ATM Q13315 1/20 0.32
POLB P06746 1/20 0.32
CA12 O43570 1/20 0.32

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
SCHEMBL29134975 0.74 ALDH1A1 (0.45) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL25379960 0.74 MEN1 (0.40) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL29128910 0.74 POLB (0.48) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL25256276 0.74 ALDH1A1 (0.40) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL29134571 0.72 MEN1 (0.38) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL29134976 0.72 MEN1 (0.38) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL29620231 0.71 TSHR (0.53) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL29620230 0.71 TSHR (0.53) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL4103602 0.71 TSHR (0.53) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL29134977 0.70 MEN1 (0.41) MEN1KMT2AALDH1A1HSD17B10TSHR

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
CN-117362147-A Hydrogenated naphthoperylene compound, intermediate, organic electroluminescent device and display device 阜阳欣奕华材料科技有限公司 2024-01-09 CN disclosed
CN-117342959-A Hydrogenated naphthoperylene compound, organic electroluminescent device and display device 阜阳欣奕华材料科技有限公司 2024-01-05 CN disclosed