SCHEMBL12558127

SCHEMBL12558127

C=C(C)[C@@H]1CC[C@]2(C(=O)NCc3cccc(OC(F)(F)F)c3)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)CC(C)(C)C(=O)O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.69
▸ TRPV1 Q8NER1 1/20 0.58
▸ PRKCG P05129 1/20 0.56
▸ NT5E P21589 7/20 0.55
▸ PRKCD Q05655 1/20 0.54
▸ CETP P11597 1/20 0.53
▸ NR1H4 Q96RI1 2/20 0.53
▸ RORC P51449 3/20 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
SCHEMBL12558148 0.94 PTPN1 (0.72) PTPN1TRPV1PRKCGNT5EPRKCD
SCHEMBL12558088 0.93 PTPN1 (0.71) PTPN1TRPV1PRKCGNT5EPRKCD
SCHEMBL12557886 0.92 TRPV1 (0.62) PTPN1TRPV1PRKCGNT5EPRKCD
SCHEMBL12558070 0.91 PTPN1 (0.71) PTPN1TRPV1PRKCGNT5EPRKCD
SCHEMBL12558049 0.88 PTPN1 (0.75) PTPN1TRPV1PRKCGNT5EPRKCD
SCHEMBL12558119 0.88 PTPN1 (0.69) PTPN1TRPV1PRKCGNT5EPRKCD
SCHEMBL12558081 0.88 PTPN1 (0.72) PTPN1TRPV1PRKCGNT5EPRKCD
SCHEMBL12558094 0.88 PTPN1 (0.76) PTPN1TRPV1PRKCGNT5EPRKCD
SCHEMBL12558056 0.88 PTPN1 (0.76) PTPN1TRPV1PRKCGNT5EPRKCD
SCHEMBL12557993 0.87 TRPV1 (0.72) PTPN1TRPV1NT5ERORC

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 6 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
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 PTPN1 3699/4885TRPV1 372/4885PRKCG 3008/4885
US-20080207573-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS HAVCR2, MAVS, CCL11 PTPN1 3699/4885TRPV1 372/4885PRKCG 3008/4885
US-20110144069-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS HAVCR2, MAVS, CCL11 PTPN1 3699/4885TRPV1 372/4885PRKCG 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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