SCHEMBL12557898

SCHEMBL12557898

C=C(C)[C@@H]1CC[C@]2(C(=O)NCCc3cccc(OC)c3)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 1/20 0.60
▸ PRKCG P05129 1/20 0.59
▸ NT5E P21589 3/20 0.58
▸ RELA Q04206 1/20 0.56
▸ RORC P51449 2/20 0.55

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
SCHEMBL12557834 0.93 TRPV1 (0.69) TRPV1PRKCGNT5ERELARORC
SCHEMBL12557842 0.93 NT5E (0.61) TRPV1PRKCGNT5ERORC
SCHEMBL12558119 0.91 PTPN1 (0.69) TRPV1PRKCGNT5ERELARORC
SCHEMBL13637671 0.89 NT5E (0.62) TRPV1PRKCGNT5ERORC
SCHEMBL13628224 0.89 NT5E (0.62) TRPV1PRKCGNT5ERORC
SCHEMBL12557893 0.88 TRPV1 (0.64) TRPV1PRKCGNT5ERELARORC
SCHEMBL12557892 0.88 NT5E (0.61) TRPV1PRKCGNT5ERORC
SCHEMBL12557916 0.88 RORC (0.67) TRPV1PRKCGNT5ERORC
SCHEMBL12557832 0.87 TRPV1 (0.68) TRPV1PRKCGNT5ERORC
SCHEMBL12557845 0.86 PRKCG (0.69) TRPV1PRKCGNT5ERORC

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110144069-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS MYRIAD GENETICS, INCORPORATED (US) 2011-06-16 — — US disclosed
US-20110144069-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS MYRIAD GENETICS, INCORPORATED (US) 2011-06-16 — — US disclosed
US-20090105203-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS MYRIAD GENETICS, INCORPORATED (US) 2009-04-23 — — US disclosed
US-20090105203-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS MYRIAD GENETICS, INCORPORATED (US) 2009-04-23 — — US disclosed
US-20080207573-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS MYRIAD GENETICS, INCORPORATED (US) 2008-08-28 — — 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 (3 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 TRPV1 372/4885PRKCG 3008/4885NT5E 573/4885
US-20080207573-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS HAVCR2, MAVS, CCL11 TRPV1 372/4885PRKCG 3008/4885NT5E 573/4885
US-20110144069-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS HAVCR2, MAVS, CCL11 TRPV1 372/4885PRKCG 3008/4885NT5E 573/4885

“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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