SCHEMBL13266239

SCHEMBL13266239

CCC(Oc1ccc(C(=O)c2ccc(Oc3ccc(S(=O)(=O)c4ccc(Cl)cc4)cc3)cc2)cc1)c1ccc(S(=O)(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.43
▸ CNR2 P34972 3/20 0.40
▸ MMP1 P03956 2/20 0.39
▸ PPARA Q07869 2/20 0.39
▸ SLC6A9 P48067 2/20 0.39
▸ ELANE P08246 1/20 0.39
▸ POLB P06746 2/20 0.38
▸ APEX1 P27695 1/20 0.38
▸ CTDSP1 Q9GZU7 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ UTS2R Q9UKP6 2/20 0.38
▸ FABP2 P12104 1/20 0.38
▸ PPARG P37231 1/20 0.38
▸ SLC22A12 Q96S37 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ MAPK1 P28482 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
SCHEMBL13082579 0.89 HTT (0.48) SLC6A9POLBAPEX1CTDSP1L3MBTL1
SCHEMBL13266190 0.89 HTT (0.48) SLC6A9POLBAPEX1CTDSP1L3MBTL1
SCHEMBL13953755 0.88 ALDH1A1 (0.48) HPGDCNR2PPARASLC6A9POLB
SCHEMBL17209192 0.84 HPGD (0.50) HPGDCNR2MMP1PPARAELANE
SCHEMBL12960262 0.82 HPGD (0.56) HPGDMMP1PPARAELANEPOLB
SCHEMBL17207952 0.82 HPGD (0.56) HPGDMMP1PPARAELANEPOLB
SCHEMBL809347 0.82 HPGD (0.56) HPGDMMP1PPARAELANEPOLB
SCHEMBL12960261 0.82 HPGD (0.56) HPGDMMP1PPARAELANEPOLB
SCHEMBL822929 0.82 HPGD (0.56) HPGDMMP1PPARAELANEPOLB
SCHEMBL11960419 0.82 ALDH1A1 (0.42) HPGDCNR2SLC6A9L3MBTL1MAPT

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
US-8293905-B2 Bipyridine compound, transition metal complex, and method for production of conjugated aromatic compound using the transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-23 — — US disclosed
US-20100184978-A1 BIPYRIDINE COMPOUND, TRANSITION METAL COMPLEX, AND METHOD FOR PRODUCTION OF CONJUGATED AROMATIC COMPOUND USING THE TRANSITION METAL COMPLEX SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-07-22 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100184978-A1 BIPYRIDINE COMPOUND, TRANSITION METAL COMPLEX, AND METHOD FOR PRODUCTION OF CONJUGATED AROMATIC COMPOUND USING THE TRANSITION METAL COMPLEX C9, C5, AP2M1 HPGD 3311/4885CNR2 3646/4885MMP1 4628/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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