SCHEMBL5745253

SCHEMBL5745253

Oc1c(-c2c(Br)c(Br)c3ccccc3c2O)ccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.47
▸ PTPN22 Q9Y2R2 1/20 0.46
▸ LDHA P00338 1/20 0.40
▸ NQO1 P15559 1/20 0.39
▸ TDP1 Q9NUW8 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ NFKB2 Q00653 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ RELA Q04206 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ DHFR P00374 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ CYP2A6 P11509 1/20 0.37
▸ TSHR P16473 1/20 0.37

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
SCHEMBL1150948 0.82 PTPN22 (0.52) PTPN22LDHANQO1TDP1MEN1
SCHEMBL18263183 0.78 POLB (0.59) POLBPTPN22LDHATDP1HSD17B10
SCHEMBL1776619 0.77 POLB (0.36) POLBPTPN22LDHAMEN1MAPT
SCHEMBL374807 0.77 PTPN22 (0.65) POLBPTPN22LDHATDP1HSD17B10
SCHEMBL29401627 0.77 PTPN22 (0.65) POLBPTPN22LDHATDP1HSD17B10
SCHEMBL18263218 0.75 PTPN22 (0.48) POLBPTPN22LDHAMAPK1ALDH1A1
SCHEMBL1840828 0.75 PTPN22 (0.62) POLBPTPN22LDHATDP1HSD17B10
SCHEMBL9060860 0.75 PTPN22 (0.62) POLBPTPN22LDHATDP1HSD17B10
SCHEMBL5155985 0.75 PTPN22 (0.62) POLBPTPN22LDHATDP1HSD17B10
SCHEMBL22534465 0.74 PTPN22 (0.57) POLBPTPN22LDHATDP1HSD17B10

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2004622-B1 CHIRAL BINAPHTHYL SULFATES FOR USE AS LIQUID CRYSTAL MATERIALS MERCK PATENT GMBH (DE) 2011-12-14 — — EP claimed
CN-113474321-B Compound having binaphthyl skeleton and method for producing compound having binaphthyl skeleton 帝人株式会社 2023-12-15 — — CN disclosed
CN-110770226-B Sulfoximine glycosidase inhibitors 阿森纽荣股份公司 2023-11-10 — — CN disclosed
CN-113474321-A Compound having binaphthyl skeleton and method for producing compound having binaphthyl skeleton 帝人株式会社 2021-10-01 — — CN disclosed
CN-113166083-A Succinate and fumarate acid addition salts of piperazine derivatives as glycosidase inhibitors 阿森纽荣股份公司 2021-07-23 — — CN disclosed
CN-110770226-A Sulfoximine glycosidase inhibitors 阿森纽荣股份公司 2020-02-07 — — CN disclosed
EP-1151987-B1 OPTICALLY ACTIVE FLUORINATED BINAPHTHOL DERIVATIVE JAPAN SCIENCE & TECH AGENCY (JP) 2006-10-25 — — EP disclosed
US-6476250-B1 Optically active fluorinated binaphthol derivative JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2002-11-05 — — US disclosed
EP-1151987-A1 OPTICALLY ACTIVE FLUORINATED BINAPHTHOL DERIVATIVE Japan Science and Technology Corporation (JP) 2001-11-07 — — EP disclosed
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