SCHEMBL12593032

SCHEMBL12593032

C=C(C)C1CCC2(C(=O)NCc3ccccn3)CC[C@]3(C)C(CCC4C5(C)CCC(OC(=O)CC(C)(C)C(=O)O)C(C)(C)C5CCC43C)C12

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.71
▸ PRKCG P05129 1/20 0.58
▸ PRKCD Q05655 1/20 0.56
▸ CETP P11597 1/20 0.55
▸ RORC P51449 3/20 0.55
▸ TRPV1 Q8NER1 1/20 0.55
▸ NT5E P21589 7/20 0.54
▸ NR1H4 Q96RI1 2/20 0.54

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
SCHEMBL12558108 1.00 PTPN1 (0.71) PTPN1PRKCGPRKCDCETPRORC
SCHEMBL13876991 1.00 PTPN1 (0.71) PTPN1PRKCGPRKCDCETPRORC
SCHEMBL12558130 0.94 PTPN1 (0.69) PTPN1PRKCGPRKCDCETPRORC
SCHEMBL12558179 0.91 PTPN1 (0.69) PTPN1PRKCGPRKCDCETPRORC
SCHEMBL12558182 0.91 PTPN1 (0.71) PTPN1PRKCGPRKCDCETPRORC
SCHEMBL12558172 0.91 PTPN1 (0.70) PTPN1PRKCGPRKCDCETPRORC
SCHEMBL12557912 0.90 PRKCG (0.63) PRKCGPRKCDCETPRORCTRPV1
SCHEMBL14628338 0.90 PRKCG (0.63) PRKCGPRKCDCETPRORCTRPV1
SCHEMBL12558177 0.90 PTPN1 (0.69) PTPN1PRKCGPRKCDCETPRORC
SCHEMBL12558181 0.90 PTPN1 (0.69) PTPN1PRKCGPRKCDCETPRORC

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 2 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-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 (2 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 3699/4885PRKCG 3008/4885PRKCD 3851/4885
US-20110144069-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS HAVCR2, MAVS, CCL11 PTPN1 3699/4885PRKCG 3008/4885PRKCD 3851/4885

“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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