SCHEMBL4453635

SCHEMBL4453635

C=C(COC)[C@@H]1CC[C@]2(C(=O)NCCc3cccc(C(=O)NCc4ccc(C(=O)O)cn4)c3)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C12

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 1/20 0.51
▸ RORC P51449 14/20 0.49
▸ EGLN2 Q96KS0 1/20 0.43
▸ EGLN1 Q9GZT9 1/20 0.43
▸ EGLN3 Q9H6Z9 1/20 0.43
▸ P4HTM Q9NXG6 1/20 0.43
▸ USP2 O75604 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ PTPN1 P18031 1/20 0.43

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
SCHEMBL13628310 0.93 RORC (0.58) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL4440197 0.91 RORC (0.53) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL4447638 0.90 RORC (0.49) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL4445786 0.90 RORC (0.48) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL13628623 0.87 RORC (0.48) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL13637471 0.87 RORC (0.48) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL4451635 0.87 RORC (0.48) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL4451644 0.87 RORC (0.48) TRPV1RORCEGLN2EGLN1EGLN3
SCHEMBL4451279 0.86 RORC (0.44) TRPV1RORC
SCHEMBL13628624 0.86 RORC (0.44) TRPV1RORC

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-20090275583-A1 ANTIVIRAL COMPOUNDS AND USE THEREOF MYRIAD GENETICS, INCORPORATED (US) 2009-11-05 — — US disclosed
US-20090275583-A1 ANTIVIRAL COMPOUNDS AND USE THEREOF MYRIAD GENETICS, INCORPORATED (US) 2009-11-05 — — 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-20090275583-A1 ANTIVIRAL COMPOUNDS AND USE THEREOF MAVS, ZC3HAV1, EIF2AK2 TRPV1 3411/4885RORC 514/4885EGLN2 1007/4885

“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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