SCHEMBL23803216

SCHEMBL23803216

N#C[C@]1(C[O])O[C@@H](c2ccc3c(N)ncnn23)[C@H](O)[C@@H]1O

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.47
▸ DOT1L Q8TEK3 5/20 0.35
▸ TMPRSS2 O15393 1/20 0.34
▸ STING1 Q86WV6 1/20 0.34
▸ MAP4K4 O95819 1/20 0.34
▸ PIK3CD O00329 2/20 0.31

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
SCHEMBL28378455 1.00 POLRMT (0.47) POLRMTDOT1LTMPRSS2STING1MAP4K4
SCHEMBL19768739 0.90 POLRMT (0.46) POLRMTDOT1LTMPRSS2STING1MAP4K4
SCHEMBL16708508 0.90 POLRMT (0.46) POLRMTDOT1LTMPRSS2STING1MAP4K4
SCHEMBL19779087 0.90 POLRMT (0.46) POLRMTDOT1LTMPRSS2STING1MAP4K4
Hydrochloric Acid SCHEMBL25392678 0.89 POLRMT (0.45) POLRMTDOT1LTMPRSS2STING1MAP4K4
Hydrochloric Acid SCHEMBL25392672 0.88 POLRMT (0.45) POLRMTDOT1LTMPRSS2STING1MAP4K4
SCHEMBL26828475 0.86 POLRMT (0.47) POLRMTDOT1LTMPRSS2STING1MAP4K4
SCHEMBL25434682 0.85 POLRMT (0.47) POLRMTDOT1LTMPRSS2STING1PIK3CD
SCHEMBL25386328 0.85 POLRMT (0.47) POLRMTDOT1LTMPRSS2STING1PIK3CD
SCHEMBL31216435 0.84 POLRMT (0.42) POLRMTDOT1LTMPRSS2STING1MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240174704-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2024-05-30 — — US disclosed
US-11767337-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2023-09-26 — — US disclosed
US-20210284670-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2021-09-16 — — 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-20210284670-A1 ANTIVIRAL COMPOUNDS MAVS, HAVCR2, ZC3HAV1 POLRMT 535/4885DOT1L 3143/4885TMPRSS2 324/4885
US-11767337-B2 Antiviral compounds MAVS, HAVCR2, ZC3HAV1 POLRMT 535/4885DOT1L 3143/4885TMPRSS2 324/4885
US-20240174704-A1 ANTIVIRAL COMPOUNDS MAVS, HAVCR2, ZC3HAV1 POLRMT 535/4885DOT1L 3143/4885TMPRSS2 324/4885

“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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