SCHEMBL26810484

SCHEMBL26810484

CCc1oc2cc(S(=O)(=O)N3CCOCC3)ccc2c1C(=N)c1cc(Br)c(O)c(Br)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC22A12 Q96S37 6/20 0.49
▸ EYA3 Q99504 3/20 0.49
▸ TTR P02766 2/20 0.49
▸ PTPN1 P18031 3/20 0.47
▸ TSHR P16473 2/20 0.47
▸ PTPRC P08575 1/20 0.47
▸ PTPN2 P17706 1/20 0.47
▸ LMNA P02545 5/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ USP2 O75604 2/20 0.45
▸ CYP2C9 P11712 2/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ MAPT P10636 2/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ EYA2 O00167 1/20 0.45
▸ ABCC4 O15439 1/20 0.45
▸ PLIN1 O60240 1/20 0.45

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
SCHEMBL26810476 0.91 SLC22A12 (0.61) SLC22A12EYA3TTRPTPN1TSHR
SCHEMBL26668797 0.88 SLC22A12 (0.48) SLC22A12EYA3TTRPTPN1TSHR
SCHEMBL26810032 0.83 SLC22A12 (0.57) SLC22A12EYA3TTRPTPN1TSHR
SCHEMBL26668799 0.80 SLC22A12 (0.49) SLC22A12EYA3TTRPTPN1TSHR
SCHEMBL26668798 0.80 SLC22A12 (0.49) SLC22A12EYA3TTRPTPN1TSHR
SCHEMBL26810890 0.79 SLC22A12 (0.52) SLC22A12EYA3TTRPTPN1TSHR
SCHEMBL4311788 0.75 SLC22A12 (0.73) SLC22A12EYA3TTRPTPN1TSHR
SCHEMBL30674930 0.74 PTPN1 (0.45) SLC22A12EYA3TTRPTPN1TSHR
SCHEMBL26668795 0.74 PTPN1 (0.45) SLC22A12EYA3TTRPTPN1TSHR
SCHEMBL4320310 0.71 SLC22A12 (0.69) SLC22A12EYA3TTRPTPN1TSHR

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-2023229099-A1 BENZOFURANYL HYDROXYPHENYL METHANONE OXIME DERIVATIVE AND USES THEREOF (주)이노보테라퓨틱스 2023-11-30 — — WO disclosed
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