SCHEMBL24680960

SCHEMBL24680960

CC(C)=NOC(=O)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.34
TSHR P16473 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
ELANE P08246 1/20 0.30
CA14 Q9ULX7 1/20 0.30
FAAH O00519 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
SCHEMBL11103345 0.80 SMN1; SMN2 (0.32) SMN1; SMN2CA12CA1CA2CA9
SCHEMBL8438902 0.77 MIF (0.37) MIF
Hydrochloric Acid SCHEMBL31551433 0.75 SLC7A5 (0.39) SMN1; SMN2CA12CA1CA2CA9
SCHEMBL29706081 0.75 MIF (0.42) MIFSMN1; SMN2TSHRELANECA14
Hydrochloric Acid SCHEMBL30838779 0.72 MIF (0.41) MIFELANECA14
SCHEMBL331491 0.72
SCHEMBL13931313 0.71 SMN1; SMN2 (0.39) SMN1; SMN2TSHRCA12CA1CA2
SCHEMBL11809884 0.71 SMN1; SMN2 (0.39) SMN1; SMN2TSHRCA12CA1CA2
SCHEMBL128484 0.71
SCHEMBL8323403 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022168106-A1 CHEMO-ENZYMATIC PROCESS FOR SYNTHESIS OF MOLNUPIRAVIR FERMENTA BIOTECH LIMITED (IN) 2022-08-11 WO claimed
EP-4658663-A2 PRODRUGS OF 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS Merck Sharp & Dohme LLC (US) 2025-12-10 EP disclosed
WO-2024163262-A2 PRODRUGS OF 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME LLC (US) 2024-08-08 WO disclosed
US-20230015308-A1 SUBSTITUTED THIAZOLE AROMATIC RING-BASED COMPOUND AND PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 2023-01-19 US disclosed
CN-112608357-B Preparation method of antiviral drug Molnbupiravir 杭州科巢生物科技有限公司 2022-12-09 CN disclosed
WO-2022208508-A1 SCALABLE TWO STEP SYNTHESIS OF MOLNUPIRAVIR FERMENTA BIOTECH LIMITED (IN) 2022-10-06 WO disclosed
WO-2022168106-A1 CHEMO-ENZYMATIC PROCESS FOR SYNTHESIS OF MOLNUPIRAVIR FERMENTA BIOTECH LIMITED (IN) 2022-08-11 WO disclosed
US-11407779-B1 Process for the preparation of molnupiravir DIVI'S LABORATORIES LTD. (IN) 2022-08-09 US disclosed
CN-112608357-A Preparation method of antiviral drug Molnbupiravir 杭州科巢生物科技有限公司 2021-04-06 CN 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-11407779-B1 Process for the preparation of molnupiravir ALKBH1, ALKBH5, ALKBH3 MIF 422/4885SMN1; SMN2 2809/4885TSHR 1552/4885
US-20230015308-A1 SUBSTITUTED THIAZOLE AROMATIC RING-BASED COMPOUND AND PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF WEE1, CBR3, GLRX3 MIF 3962/4885SMN1; SMN2 4661/4885TSHR 2536/4885

“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.