SCHEMBL16406483

SCHEMBL16406483

C#CO/C(C)=C/CC/C(C)=C/CCC1(C)Oc2c(C=O)c(C=O)cc(O)c2CC1O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 15/20 0.41
▸ ST6GAL1 P15907 1/20 0.37
▸ FUT6 P51993 1/20 0.37
▸ FUT5 Q11128 1/20 0.37
▸ ST3GAL1 Q11201 1/20 0.37
▸ ST3GAL3 Q11203 1/20 0.37
▸ MAOB P27338 1/20 0.32
▸ NR1I2 O75469 1/20 0.32
▸ PPARG P37231 1/20 0.32
▸ PPARA Q07869 1/20 0.32

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
SCHEMBL16406504 0.89 ALOX5 (0.44) ALOX5ST6GAL1FUT6FUT5ST3GAL1
SCHEMBL16406480 0.89 ALOX5 (0.44) ALOX5ST6GAL1FUT6FUT5ST3GAL1
SCHEMBL30075081 0.89 ALOX5 (0.44) ALOX5ST6GAL1FUT6FUT5ST3GAL1
SCHEMBL16406481 0.83 ALOX5 (0.41) ALOX5ST6GAL1FUT6FUT5ST3GAL1
SCHEMBL16406484 0.79 ALOX5 (0.44) ALOX5ST6GAL1FUT6FUT5ST3GAL1
SCHEMBL16406486 0.79 DHODH (0.45) ALOX5ST6GAL1FUT6FUT5ST3GAL1
SCHEMBL30645386 0.78 ALOX5 (0.45) ALOX5MAOB
SCHEMBL16406492 0.77 APP (0.44) ALOX5MAOB
SCHEMBL16406491 0.77 ALOX5 (0.42) ALOX5MAOB
SCHEMBL21972848 0.77 ALOX5 (0.39) ALOX5ST6GAL1FUT6FUT5ST3GAL1

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-9216987-B2 Chroman derivative TMS CO., LTD. (JP) 2015-12-22 — — US disclosed
US-20150025251-A1 CHROMAN DERIVATIVE TMS CO., LTD. (JP) 2015-01-22 — — 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-20150025251-A1 CHROMAN DERIVATIVE CDYL, CNOT1, CNPY2 ALOX5 3596/4885ST6GAL1 3125/4885FUT6 4226/4885

“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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