SCHEMBL14012277

SCHEMBL14012277

Cc1cccc(-c2c3nc(c(-c4cccc(OC5OC(CO)C(O)C(O)C5O)c4)c4ccc([nH]4)c(-c4cccc(C)c4)c4nc(c(-c5cccc(OC6OC(CO)C(O)C(O)C6O)c5)c5ccc2[nH]5)C=C4)C=C3)c1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SLC5A2 P31639 3/20 0.46
▸ SLC5A1 P13866 2/20 0.46
▸ POLB P06746 1/20 0.45
▸ TYR P14679 2/20 0.44
▸ EPHX2 P34913 1/20 0.44
▸ CA12 O43570 3/20 0.41
▸ CA9 Q16790 3/20 0.41
▸ CA1 P00915 2/20 0.41
▸ CA2 P00918 1/20 0.41

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
SCHEMBL24218341 0.94 TYR (0.46) SLC5A2POLBTYR
SCHEMBL22111092 0.94 TYR (0.46) SLC5A2POLBTYR
SCHEMBL22111051 0.92 TYR (0.44) SLC5A2SLC5A1TYR
SCHEMBL24218354 0.92 TYR (0.44) SLC5A2SLC5A1TYR
SCHEMBL14181427 0.92 TYR (0.44) SLC5A2SLC5A1TYR
SCHEMBL13454448 0.89 TYR (0.42) SLC5A2POLBTYR
SCHEMBL17676524 0.89 TYR (0.42) SLC5A2POLBTYR
SCHEMBL13469647 0.89 TYR (0.42) SLC5A2POLBTYR
SCHEMBL4395822 0.88 TYR (0.41) SLC5A2POLBTYR
SCHEMBL17676268 0.87 TYR (0.41) POLBTYR

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
US-20080279781-A1 Glycosylated Carboranylporphyrins and Uses Thereof BROOKHAVEN SCIENCE ASSOCIATES, LLC (US) 2008-11-13 — — 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-20080279781-A1 Glycosylated Carboranylporphyrins and Uses Thereof BTD, MPI, SLC17A5 SLC5A2 449/4885SLC5A1 215/4885POLB 4327/4885

“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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