SCHEMBL29134571

SCHEMBL29134571

Clc1cccc2ccc(CBr)c(Br)c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
ALDH1A1 P00352 3/20 0.38
HSD17B10 Q99714 3/20 0.38
TSHR P16473 2/20 0.38
RXFP1 Q9HBX9 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GPR84 Q9NQS5 1/20 0.37
CYP1A2 P05177 3/20 0.36
HPGD P15428 2/20 0.36
CYP1A1 P04798 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP1B1 Q16678 1/20 0.36
CYP2A6 P11509 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
GAA P10253 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PNMT P11086 1/20 0.31
POLB P06746 2/20 0.31

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
SCHEMBL29134567 0.84 ALDH1A1 (0.40) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL7183195 0.76 PNMT (0.43) TSHRGPR84CYP1A2CYP2A6PNMT
SCHEMBL29128910 0.73 POLB (0.48) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL29134975 0.73 ALDH1A1 (0.45) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL25379960 0.73 MEN1 (0.40) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL25256276 0.73 ALDH1A1 (0.40) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL29134573 0.72 MEN1 (0.39) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL28069900 0.71 ALDH1A1 (0.42) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL5598415 0.71 ALDH1A1 (0.50) MEN1KMT2AALDH1A1HSD17B10TSHR
SCHEMBL29134976 0.70 MEN1 (0.38) 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