SCHEMBL25584077

SCHEMBL25584077

CCCCCC/C=C\C/C=C\CCCCCCCCOC(=O)[C@H](C)NP(=O)(OC[C@H]1O[C@@H](c2ccc3c(N)ncnn23)[C@H](O)[C@@H]1O)Oc1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.36
▸ CYP2C9 P11712 2/20 0.36
▸ ADK P55263 1/20 0.34
▸ DOT1L Q8TEK3 1/20 0.32
▸ BTN3A1 O00481 2/20 0.32
▸ RIPK1 Q13546 1/20 0.32
▸ POLRMT O00411 1/20 0.32

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
SCHEMBL25584089 0.95 CYP3A4 (0.39) CYP3A4CYP2C9ADKDOT1LPOLRMT
SCHEMBL25584387 0.92 CYP3A4 (0.36) CYP3A4CYP2C9ADKDOT1LBTN3A1
SCHEMBL25584101 0.92 CYP3A4 (0.38) CYP3A4CYP2C9ADKBTN3A1
SCHEMBL25584597 0.91 ADK (0.32) ADKPOLRMT
SCHEMBL25584081 0.91 ADK (0.32) ADKPOLRMT
SCHEMBL26282459 0.89 CYP3A4 (0.40) CYP3A4CYP2C9DOT1LBTN3A1RIPK1
SCHEMBL21283660 0.88 CYP3A4 (0.42) CYP3A4CYP2C9BTN3A1POLRMT
SCHEMBL25584428 0.86 CYP3A4 (0.39) CYP3A4CYP2C9ADKDOT1LBTN3A1
SCHEMBL25584095 0.86 CYP3A4 (0.41) CYP3A4CYP2C9ADKBTN3A1
SCHEMBL26288030 0.86 CYP3A4 (0.42) CYP3A4CYP2C9BTN3A1RIPK1POLRMT

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-20230183282-A1 REMDESIVIR AND REMDESIVIR ANALOGS, SOLUTIONS, AND NANOPARTICLE, LIPOSOMAL, AND MICROPARTICLE COMPOSITIONS FOR TREATING VIRAL INFECTIONS THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2023-06-15 — — 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-20230183282-A1 REMDESIVIR AND REMDESIVIR ANALOGS, SOLUTIONS, AND NANOPARTICLE, LIPOSOMAL, AND MICROPARTICLE COMPOSITIONS FOR TREATING VIRAL INFECTIONS ALB, ACE, ACE2 CYP3A4 187/4885CYP2C9 288/4885ADK 868/4885

“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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