SCHEMBL19220264

SCHEMBL19220264

CC(C)(C)NC(=O)O[C@@H]1CCn2ccnc21

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
SSTR4 P31391 3/20 0.32
CCNE1 P24864 8/20 0.32
CDK2 P24941 8/20 0.32
GSK3B P49841 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NTMT1 Q9BV86 3/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 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
SCHEMBL25519258 1.00 GAA (0.33) GAASSTR4CCNE1CDK2GSK3B
SCHEMBL25519260 0.86 EPHX1 (0.36) SSTR4NTMT1LMNA
SCHEMBL20998179 0.86 CHRM1 (0.38)
SCHEMBL25519261 0.81 CDK2 (0.37) CCNE1CDK2GSK3BSMN1; SMN2
SCHEMBL25519241 0.81 CHRM2 (0.34)
SCHEMBL19220263 0.81 CHRM2 (0.34)
SCHEMBL25519601 0.80 TSHR (0.37) SSTR4SMN1; SMN2LMNA
SCHEMBL25519242 0.80 GPR119 (0.38)
SCHEMBL25519266 0.78 CNR2 (0.31)
SCHEMBL29215627 0.78 EPHX2 (0.36) GAASSTR4SMN1; SMN2LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230381761-A1 CATALYSTS AND THEIR USES IN ONE-POT DIASTEREOSELECTIVE SYNTHESIS OF REMDESIVIR ACADEMIA SINICA (TW) 2023-11-30 US disclosed
US-10597422-B2 Process for making chloro-substituted nucleoside phosphoramidate compounds MERCK SHARP & DOHME CORP. (US) 2020-03-24 US disclosed
US-20190144485-A1 Process for Making Chloro-substituted Nucleoside Phosphoramidate Compounds MERCK SHARP & DOHME LLC 2019-05-16 US disclosed
US-20170226146-A1 PROCESS FOR MAKING CHLORO-SUBSTITUTED NUCLEOSIDE PHOSPHORAMIDATE COMPOUNDS MERCK SHARP & DOHME LLC 2017-08-10 US disclosed
US-20170226146-A1 PROCESS FOR MAKING CHLORO-SUBSTITUTED NUCLEOSIDE PHOSPHORAMIDATE COMPOUNDS MERCK SHARP & DOHME LLC 2017-08-10 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 (4 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-20190144485-A1 Process for Making Chloro-substituted Nucleoside Phosphoramidate Compounds NUDT1, PNP, SAMHD1 GAA 518/4885SSTR4 3715/4885CCNE1 555/4885
US-20170226146-A1 PROCESS FOR MAKING CHLORO-SUBSTITUTED NUCLEOSIDE PHOSPHORAMIDATE COMPOUNDS NUDT1, PNP, SAMHD1 GAA 518/4885SSTR4 3715/4885CCNE1 555/4885
US-20230381761-A1 CATALYSTS AND THEIR USES IN ONE-POT DIASTEREOSELECTIVE SYNTHESIS OF REMDESIVIR MTAP, PNP, ALKBH1 GAA 33/4885SSTR4 4675/4885CCNE1 4249/4885
US-10597422-B2 Process for making chloro-substituted nucleoside phosphoramidate compounds NUDT1, PNP, SAMHD1 GAA 518/4885SSTR4 3715/4885CCNE1 555/4885

“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.