SCHEMBL21972850

SCHEMBL21972850

CC(C)=CCC/C(C)=C/CC[C@@]1(C)CCc2c(O)cc(C=O)c(C=O)c2O1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 19/20 0.61
▸ NR1I2 O75469 1/20 0.48
▸ PPARG P37231 1/20 0.48
▸ PPARA Q07869 1/20 0.48

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
SCHEMBL18584114 0.84 ALOX5 (0.84) ALOX5NR1I2PPARGPPARA
SCHEMBL30075081 0.82 ALOX5 (0.44) ALOX5
SCHEMBL16406480 0.82 ALOX5 (0.44) ALOX5
SCHEMBL16406504 0.82 ALOX5 (0.44) ALOX5
SCHEMBL21538203 0.80 ALOX5 (0.52) ALOX5NR1I2PPARGPPARA
SCHEMBL18583910 0.78 ALOX5 (0.65) ALOX5NR1I2PPARGPPARA
SCHEMBL16430159 0.78 ALOX5 (0.83) ALOX5
SCHEMBL66599 0.78 ALOX5 (0.83) ALOX5
SCHEMBL2365123 0.78 ALOX5 (0.83) ALOX5
SCHEMBL2694076 0.78 ALOX5 (0.83) ALOX5

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-20200140450-A1 CHEMICAL METHOD OF PRODUCING SMTP GROUPS OR SMTP-7 AND INTERMEDIATES USED IN THE METHOD SHOWA UNIVERSITY (JP) 2020-05-07 — — 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-20200140450-A1 CHEMICAL METHOD OF PRODUCING SMTP GROUPS OR SMTP-7 AND INTERMEDIATES USED IN THE METHOD TST, SMS, TMSB4X ALOX5 4654/4885NR1I2 2001/4885PPARG 4026/4885

“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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