SCHEMBL20089274

SCHEMBL20089274

Cc1c(O)c2c(c(O)c1C(C)C)C(C=O)=C1C(C)(C)CCC[C@@]12C

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 1/20 0.30
▸ MCL1 Q07820 1/20 0.30

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
Taiwaniaquinol D SCHEMBL18105235 0.84 AKR1B1 (0.35) —
Taiwaniaquinol D SCHEMBL31237203 0.84 AKR1B1 (0.35) —
SCHEMBL4778751 0.70 CACNA1G (0.31) —
Taiwaniaquinone D SCHEMBL31237587 0.64 — —
SCHEMBL20089279 0.63 USP2 (0.39) —
SCHEMBL4967470 0.55 BCL2 (0.34) BCL2MCL1
SCHEMBL19020514 0.54 LDHA (0.36) BCL2MCL1
SCHEMBL11653101 0.54 BCL2 (0.38) BCL2MCL1
SCHEMBL31571680 0.52 CACNA1G (0.31) —
SCHEMBL10888504 0.52 MAOB (0.34) —

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-20180111889-A1 METHODS OF MAKING MULTICYCLIC COMPOUNDS USING MULTICOMPONENT/TANDEM REACTION SEQUENCES BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION, ON BEHALF OF THE UNIVERSITY OF NEVADA, (US) 2018-04-26 — — 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-20180111889-A1 METHODS OF MAKING MULTICYCLIC COMPOUNDS USING MULTICOMPONENT/TANDEM REACTION SEQUENCES TYMS, RTCB, POLRMT BCL2 1774/4885MCL1 187/4885

“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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