SCHEMBL16669206

SCHEMBL16669206

CC1(OC(=O)C[C@@H]2CC[C@]3(C)[C@H](CC[C@]4(C)[C@@H]3CC[C@@H]3[C@H]5CCC[C@]5(C(=O)Cl)CC[C@]34C)C2(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ USP7 Q93009 1/20 0.41
▸ GPBAR1 Q8TDU6 6/20 0.40
▸ PTPN1 P18031 1/20 0.38
▸ PRKCD Q05655 2/20 0.38
▸ CA9 Q16790 2/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38

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
SCHEMBL16671510 0.87 USP7 (0.45) USP7GPBAR1PTPN1PRKCDCA9
SCHEMBL16669528 0.87 USP7 (0.45) USP7GPBAR1PTPN1PRKCDCA9
SCHEMBL16669589 0.79 GPBAR1 (0.32) USP7GPBAR1
SCHEMBL16669216 0.75 NT5E (0.47) USP7GPBAR1PTPN1PRKCD
SCHEMBL16669545 0.74 NT5E (0.42) USP7GPBAR1PTPN1PRKCD
SCHEMBL16669687 0.72 USP7 (0.38) USP7GPBAR1PTPN1PRKCD
SCHEMBL16669357 0.72 USP7 (0.38) USP7GPBAR1PTPN1PRKCD
SCHEMBL16669204 0.72 RORC (0.54) USP7GPBAR1PTPN1PRKCD
SCHEMBL5448193 0.72 SLC10A1 (0.40) USP7GPBAR1PTPN1PRKCD
SCHEMBL14124011 0.71 USP7 (0.69) USP7GPBAR1PTPN1PRKCD

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-20150119373-A1 NOVEL BETULINIC ACID DERIVATIVES AS HIV INHIBITORS HETERO LABS LIMITED (IN) 2015-04-30 — — 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-20150119373-A1 NOVEL BETULINIC ACID DERIVATIVES AS HIV INHIBITORS BET1, PGGT1B, RABGGTB USP7 3226/4885GPBAR1 311/4885PTPN1 4078/4885

“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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