SCHEMBL13890818

SCHEMBL13890818

C=C(C)C1CCC2(C(=O)Cl)CC[C@]3(C)C(CC[C@@H]4C5(C)CCC(OC(C)=O)C(C)(C)[C@@H]5CCC43C)C12

nearest known ligand 0.73

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 6/20 0.69
▸ PRKCD Q05655 1/20 0.69
▸ PRKCG P05129 2/20 0.67
▸ CA9 Q16790 1/20 0.67
▸ CETP P11597 1/20 0.67
▸ PTPN1 P18031 1/20 0.66

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
SCHEMBL12557822 1.00 NT5E (0.69) NT5EPRKCDPRKCGCA9CETP
SCHEMBL9131707 1.00 NT5E (0.69) NT5EPRKCDPRKCGCA9CETP
SCHEMBL10214444 1.00 NT5E (0.69) NT5EPRKCDPRKCGCA9CETP
SCHEMBL14124010 1.00 NT5E (0.69) NT5EPRKCDPRKCGCA9CETP
SCHEMBL9130088 1.00 NT5E (0.69) NT5EPRKCDPRKCGCA9CETP
SCHEMBL9129432 1.00 NT5E (0.69) NT5EPRKCDPRKCGCA9CETP
SCHEMBL10214496 1.00 NT5E (0.69) NT5EPRKCDPRKCGCA9CETP
SCHEMBL14156586 1.00 NT5E (0.69) NT5EPRKCDPRKCGCA9CETP
SCHEMBL9129051 0.93 GPBAR1 (0.67) —
SCHEMBL10214539 0.93 NT5E (0.71) NT5EPRKCDPRKCGCETPPTPN1

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-20090105203-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS MYRIAD GENETICS, INCORPORATED (US) 2009-04-23 — — 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-20090105203-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS HAVCR2, MAVS, CCL11 NT5E 573/4885PRKCD 3851/4885PRKCG 3008/4885

“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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