SCHEMBL18666874

SCHEMBL18666874

CCC(CC)COC(=O)[C@H](C)N[P@@](=O)(OCC1O[C@@](C)(c2ccc3c(N)ncnn23)[C@H](O)[C@@H]1O)Oc1ccccc1

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.39
▸ CYP2C9 P11712 2/20 0.39
▸ KRAS P01116 1/20 0.33
▸ BTN3A1 O00481 4/20 0.33
▸ RIPK1 Q13546 3/20 0.33

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
SCHEMBL18636470 1.00 CYP3A4 (0.39) CYP3A4CYP2C9KRASBTN3A1RIPK1
SCHEMBL20878382 1.00 CYP3A4 (0.39) CYP3A4CYP2C9KRASBTN3A1RIPK1
SCHEMBL18636473 1.00 CYP3A4 (0.39) CYP3A4CYP2C9KRASBTN3A1RIPK1
SCHEMBL22096278 1.00 CYP3A4 (0.39) CYP3A4CYP2C9KRASBTN3A1RIPK1
SCHEMBL18636467 1.00 CYP3A4 (0.39) CYP3A4CYP2C9KRASBTN3A1RIPK1
SCHEMBL18667331 1.00 CYP3A4 (0.39) CYP3A4CYP2C9KRASBTN3A1RIPK1
SCHEMBL25012467 0.94 CYP3A4 (0.40) CYP3A4CYP2C9BTN3A1RIPK1
SCHEMBL24975049 0.94 CYP3A4 (0.40) CYP3A4CYP2C9BTN3A1RIPK1
SCHEMBL18636485 0.94 CYP3A4 (0.40) CYP3A4CYP2C9BTN3A1RIPK1
SCHEMBL23661284 0.93 CYP3A4 (0.37) CYP3A4CYP2C9KRASBTN3A1RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240207291-A1 METHODS FOR TREATING POXVIRUS INFECTIONS GILEAD SCIENCES, INC. 2024-06-27 — — US disclosed
US-20230233587-A1 REMDESIVIR TREATMENT METHODS GILEAD SCIENCES, INC. 2023-07-27 — — US disclosed
US-11701372-B2 Inhalation formulations of 1'-cyano substituted carba-nucleoside analogs GILEAD SCIENCES, INC. (US) 2023-07-18 — — US disclosed
EP-3785717-A1 METHODS FOR TREATING CORONAVIRIDAE INFECTIONS Gilead Sciences, Inc. (US) 2021-03-03 — — EP disclosed
US-10695357-B2 Methods for treating filoviridae virus infections GILEAD SCIENCES, INC. (US) 2020-06-30 — — US disclosed
US-20190275063-A1 METHODS FOR TREATING FILOVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. 2019-09-12 — — US disclosed
WO-2017049060-A1 METHODS FOR TREATING ARENAVIRIDAE AND CORONAVIRIDAE VIRUS INFECTIONS GILEAD SCIENCES, INC. (US) 2017-03-23 — — WO 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 (5 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-20190275063-A1 METHODS FOR TREATING FILOVIRIDAE VIRUS INFECTIONS PNP, PRPF4, RPIA CYP3A4 772/4885CYP2C9 2974/4885KRAS 4427/4885
US-20230233587-A1 REMDESIVIR TREATMENT METHODS EIF2AK2, MTAP, ACE CYP3A4 628/4885CYP2C9 879/4885KRAS 1899/4885
US-10695357-B2 Methods for treating filoviridae virus infections PNP, PRPF4, RPIA CYP3A4 772/4885CYP2C9 2974/4885KRAS 4427/4885
US-11701372-B2 Inhalation formulations of 1'-cyano substituted carba-nucleoside analogs SLC29A1, SLC28A1, SLC29A2 CYP3A4 1147/4885CYP2C9 633/4885KRAS 2235/4885
US-20240207291-A1 METHODS FOR TREATING POXVIRUS INFECTIONS VAC14, SDHB, XDH CYP3A4 3182/4885CYP2C9 3880/4885KRAS 1521/4885

“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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