SCHEMBL30445328

SCHEMBL30445328

COC(=O)[C@@H]1C[C@@]2(CCNC2=O)CN1C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ IMPDH2 P12268 3/20 0.39
▸ PTPN1 P18031 1/20 0.36
▸ CCNC P24863 2/20 0.36
▸ CDK8 P49336 2/20 0.36
▸ NR1H2 P55055 5/20 0.35
▸ NR1H3 Q13133 4/20 0.35
▸ HDAC8 Q9BY41 1/20 0.33
▸ RXRA P19793 3/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ OTUD7B Q6GQQ9 1/20 0.31
▸ PEPD P12955 1/20 0.31
▸ CCR2 P41597 1/20 0.31
▸ MMP2 P08253 1/20 0.30
▸ ANPEP P15144 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ NPC1 O15118 1/20 0.30

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
SCHEMBL30444941 0.93 IMPDH2 (0.38) IMPDH2PTPN1CCNCCDK8NR1H2
SCHEMBL27245010 0.88 CCNC (0.35) CCNCCDK8NR1H2NR1H3HDAC8
SCHEMBL30890386 0.88 CCNC (0.35) IMPDH2CCNCCDK8NR1H2NR1H3
SCHEMBL30445315 0.87 CCNC (0.35) CCNCCDK8NR1H2NR1H3HDAC8
SCHEMBL30445475 0.86 IMPDH2 (0.41) IMPDH2PTPN1NR1H2NR1H3HDAC8
SCHEMBL30541896 0.84 OTUD7B (0.34) CCNCCDK8OTUD7BPEPDMMP2
SCHEMBL30992279 0.81 MEN1 (0.34) IMPDH2CCNCCDK8HDAC8ALDH1A1
SCHEMBL30890560 0.81 IMPDH2 (0.39) IMPDH2PTPN1NR1H2NR1H3HDAC8
SCHEMBL27244843 0.81 HSD17B10 (0.36) CCNCCDK8NR1H2NR1H3HDAC8
SCHEMBL30890582 0.81 GRIN2B (0.35) CCNCCDK8NR1H2NR1H3HDAC8

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-11993600-B2 Saturated spirocyclics as antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2024-05-28 — — US disclosed
US-20230174531-A1 SATURATED SPIROCYCLICS AS ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2023-06-08 — — 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-11993600-B2 Saturated spirocyclics as antiviral agents ACE, ACE2, PKD1 IMPDH2 1437/4885PTPN1 570/4885CCNC 481/4885
US-20230174531-A1 SATURATED SPIROCYCLICS AS ANTIVIRAL AGENTS ACE, ACE2, PKD1 IMPDH2 1437/4885PTPN1 570/4885CCNC 481/4885

“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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