SCHEMBL31142012

SCHEMBL31142012

Brc1ccc(-n2c3ccc(Br)cc3c3cc(Br)ccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
TSHR P16473 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
DNM1 Q05193 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP2A6 P11509 1/20 0.36
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 2/20 0.36
RXFP1 Q9HBX9 1/20 0.36
FAAH O00519 1/20 0.35
MGLL Q99685 1/20 0.35
HTT P42858 2/20 0.35
HPGD P15428 1/20 0.35
P2RX3 P56373 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35

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
SCHEMBL782332 1.00 MAPT (0.43) MAPTTSHRL3MBTL1KDM4EATM
SCHEMBL31274059 0.98 MAPT (0.44) MAPTTSHRL3MBTL1KDM4EATM
SCHEMBL27939208 0.96 MAPT (0.41) MAPTTSHRL3MBTL1KDM4EATM
SCHEMBL1831835 0.91 MAPT (0.41) MAPTTSHRL3MBTL1KDM4EATM
SCHEMBL782608 0.90 L3MBTL1 (0.55) MAPTL3MBTL1KDM4EATMDNM1
SCHEMBL14845769 0.89 ALDH1A1 (0.41) MAPTTSHRKDM4EDNM1SMN1; SMN2
SCHEMBL22384785 0.89 MAPT (0.37) MAPTTSHRL3MBTL1KDM4EATM
SCHEMBL356742 0.88 ALDH1A1 (0.44) MAPTTSHRL3MBTL1KDM4EDNM1
SCHEMBL12362823 0.88 IDO1 (0.39) MAPTDNM1SMN1; SMN2RXFP1
SCHEMBL30931967 0.88 IDO1 (0.39) MAPTDNM1SMN1; SMN2RXFP1

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-118599220-B Preparation method of high-temperature-resistant and moisture-proof plastic film material 无锡睿斯特包装材料有限公司 2025-02-07 CN disclosed
CN-118599220-A Preparation method of high-temperature-resistant and moisture-proof plastic film material 无锡睿斯特包装材料有限公司 2024-09-06 CN disclosed