SCHEMBL15980975

SCHEMBL15980975

CC(C)=CCC/C(C)=C/CC/C(C)=C\COC(=O)OC(C)(C)C

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.65
ALOX15 P16050 1/20 0.65
FNTA P49354 3/20 0.54
FNTB P49356 3/20 0.54
PGGT1B P53609 1/20 0.54
TRPV1 Q8NER1 3/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL15968251 1.00 ALDH1A1 (0.65) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL15980320 1.00 ALDH1A1 (0.65) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL15980984 1.00 ALDH1A1 (0.65) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL15980319 1.00 ALDH1A1 (0.65) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL15978372 0.98 ALDH1A1 (0.67) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL15978373 0.98 ALDH1A1 (0.67) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL788923 0.88 ALDH1A1 (0.76) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL7220410 0.86 ALDH1A1 (0.79) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL28538300 0.86 ALDH1A1 (0.79) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL3358291 0.84 ALOX15 (0.44) ALDH1A1ALOX15FNTAFNTBPGGT1B

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-20140243404-A1 UNIQUE HALOGEN-INDUCED CYCLIZATIONS, REAGENTS THEREFOR, AND COMPOUNDS PRODUCED THEREBY THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2014-08-28 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-20140243404-A1 UNIQUE HALOGEN-INDUCED CYCLIZATIONS, REAGENTS THEREFOR, AND COMPOUNDS PRODUCED THEREBY WEE1, WEE2, NOTUM ALDH1A1 1556/4885ALOX15 161/4885FNTA 537/4885

“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.