SCHEMBL17106751

SCHEMBL17106751

Cc1ccc(C(=O)OC[C@H]2O[C@@H](n3cc(F)c4c(Cl)ncnc43)C[C@@H]2OC(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ UPP1 Q16831 1/20 0.43
▸ RNASE1 P07998 1/20 0.40
▸ POLB P06746 1/20 0.36
▸ ABL1 P00519 1/20 0.34
▸ YES1 P07947 1/20 0.34
▸ LYN P07948 1/20 0.34
▸ SRC P12931 1/20 0.34
▸ FGFR3 P22607 1/20 0.34
▸ KDR P35968 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ ADK P55263 1/20 0.34
▸ ABCB1 P08183 1/20 0.34
▸ PRMT5 O14744 2/20 0.33
▸ METTL3 Q86U44 2/20 0.33
▸ CA2 P00918 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ ATG7 O95352 3/20 0.32
▸ HSPA2 P54652 1/20 0.32

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
SCHEMBL17106754 1.00 UPP1 (0.43) UPP1RNASE1POLBABL1YES1
SCHEMBL17106753 1.00 UPP1 (0.43) UPP1RNASE1POLBABL1YES1
SCHEMBL23786470 0.93 UPP1 (0.51) UPP1RNASE1POLBADKABCB1
SCHEMBL17106856 0.92 UPP1 (0.44) UPP1RNASE1POLBABL1YES1
SCHEMBL17114357 0.92 UPP1 (0.44) UPP1RNASE1POLBABL1YES1
SCHEMBL17106852 0.92 RNASE1 (0.45) UPP1RNASE1POLBABL1YES1
SCHEMBL17106855 0.92 RNASE1 (0.45) UPP1RNASE1POLBABL1YES1
SCHEMBL17111263 0.92 UPP1 (0.44) UPP1RNASE1POLBABL1YES1
SCHEMBL17106853 0.92 UPP1 (0.44) UPP1RNASE1POLBABL1YES1
SCHEMBL17106851 0.92 UPP1 (0.44) UPP1RNASE1POLBABL1YES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180002366-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-01-04 — — US disclosed
US-20180002366-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-01-04 — — US disclosed
US-9777035-B2 4′-substituted nucleoside reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. (US) 2017-10-03 — — US disclosed
US-9777035-B2 4′-substituted nucleoside reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. (US) 2017-10-03 — — US disclosed
US-9777035-B2 4′-substituted nucleoside reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. (US) 2017-10-03 — — US disclosed
EP-3122752-A1 4'-SUBSTITUTED NUCLEOSIDE-DERIVATIVES AS HIV REVERSE TRANSCRIPTASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2017-02-01 — — EP disclosed
WO-2015148746-A1 4'-SUBSTITUTED NUCLEOSIDE-DERIVATIVES AS HIV REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-10-01 — — WO disclosed
US-20150274767-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-10-01 — — US disclosed
US-20150274767-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-10-01 — — US disclosed
WO-2015148746-A1 4'-SUBSTITUTED NUCLEOSIDE-DERIVATIVES AS HIV REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-10-01 — — WO disclosed
US-20150274767-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-10-01 — — US disclosed
WO-2015143712-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-10-01 — — WO disclosed
WO-2015143712-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-10-01 — — 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 (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-20180002366-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS DUT, HPRT1, RNGTT UPP1 64/4885RNASE1 171/4885POLB 12/4885
US-20150274767-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS DUT, HPRT1, RNGTT UPP1 64/4885RNASE1 171/4885POLB 12/4885

“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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