SCHEMBL8815638

SCHEMBL8815638

O=c1c2cc(Cl)cc(Cl)c2oc2c(Cl)cc(Cl)cc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 7/20 0.57
▸ PTPN1 P18031 1/20 0.53
▸ CSNK2A2 P19784 3/20 0.49
▸ CSNK2B P67870 3/20 0.49
▸ CSNK2A1 P68400 3/20 0.49
▸ CSNK2A3 Q8NEV1 1/20 0.49
▸ TTR P02766 2/20 0.47
▸ MARK4 Q96L34 2/20 0.41
▸ GPR35 Q9HC97 2/20 0.41
▸ USP2 O75604 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ CASP1 P29466 1/20 0.41
▸ CASP7 P55210 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ CA12 O43570 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40

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
SCHEMBL10473986 0.85 AHR (0.68) AHRPTPN1CSNK2A2CSNK2BCSNK2A1
SCHEMBL31174010 0.82 TTR (0.67) AHRTTRHPGDCASP1CASP7
SCHEMBL5346099 0.82 TTR (0.67) AHRTTRHPGDCASP1CASP7
SCHEMBL19661827 0.78 AHR (0.50) AHRPTPN1CSNK2A2CSNK2BCSNK2A1
SCHEMBL16477279 0.78 MAPT (0.50) AHRCSNK2A2CSNK2BCSNK2A1TTR
SCHEMBL31217546 0.77 AHR (0.44) AHRPTPN1CSNK2A2CSNK2BCSNK2A1
SCHEMBL31619649 0.77 AHR (0.44) AHRPTPN1CSNK2A2CSNK2BCSNK2A1
SCHEMBL29952252 0.75 PTPN1 (0.51) AHRPTPN1CSNK2A2CSNK2BCSNK2A1
SCHEMBL16480062 0.75 KDM4E (0.65) CSNK2A2CSNK2BHPGDHSD17B10CA12
SCHEMBL11541084 0.74 PTPN1 (0.58) AHRPTPN1CSNK2A2CSNK2BCSNK2A1

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-1997006178-A1 PYRIMIDINE NUCLEOSIDES F. HOFFMANN-LA ROCHE AG (CH) 1997-02-20 — — WO disclosed
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