SCHEMBL25391064

SCHEMBL25391064

CCCCc1oc2c(F)c(F)ccc2c1C(=O)c1cc(Br)c(O)c(Br)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 3/20 0.63
▸ SLC22A12 Q96S37 10/20 0.49
▸ EYA3 Q99504 5/20 0.49
▸ PTPN1 P18031 3/20 0.47
▸ CYP2C9 P11712 2/20 0.47
▸ CYP2C19 P33261 2/20 0.47
▸ ESR1 P03372 2/20 0.47
▸ EYA2 O00167 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ ABCC4 O15439 1/20 0.47
▸ PLIN1 O60240 1/20 0.47
▸ NR1I2 O75469 1/20 0.47
▸ USP2 O75604 1/20 0.47
▸ ABCB11 O95342 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ ALB P02768 1/20 0.47
▸ NR3C1 P04150 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ PGR P06401 1/20 0.47

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
SCHEMBL25389825 0.88 EYA3 (0.62) TTREYA3CYP2C9MEN1ABCB11
SCHEMBL25390240 0.87 TTR (0.69) TTRSLC22A12EYA3PTPN1CYP2C9
SCHEMBL25389953 0.81 TTR (0.74) TTRSLC22A12EYA3PTPN1CYP2C9
SCHEMBL25391104 0.81 TTR (0.71) TTRSLC22A12EYA3PTPN1CYP2C9
SCHEMBL25390573 0.81 TTR (0.71) TTRSLC22A12EYA3PTPN1CYP2C9
SCHEMBL25387610 0.80 TTR (0.60) TTRSLC22A12EYA3PTPN1CYP2C9
SCHEMBL25388498 0.79 TTR (0.74) TTRSLC22A12EYA3PTPN1CYP2C9
SCHEMBL25389800 0.79 TTR (0.74) TTRSLC22A12EYA3PTPN1CYP2C9
SCHEMBL1287644 0.77 TTR (1.00) TTRSLC22A12EYA3PTPN1CYP2C9
SCHEMBL25389864 0.77 TTR (0.74) TTRSLC22A12EYA3PTPN1CYP2C9

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-2023149549-A1 NOVEL PHARMACEUTICAL COMPOSITION 国立大学法人富山大学 2023-08-10 — — WO disclosed
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