SCHEMBL1845474

SCHEMBL1845474

CC(=O)OC(C)=O.CN(C)c1ccncc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.64
CHKA P35790 1/20 0.64
MAPT P10636 8/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 8/20 0.46
KDM4E B2RXH2 5/20 0.46
GFER P55789 1/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
ALOX15 P16050 2/20 0.46
CASP1 P29466 1/20 0.46
HBB P68871 1/20 0.46
HPGD P15428 1/20 0.42
MPO P05164 1/20 0.42
HTT P42858 1/20 0.42
MAOB P27338 1/20 0.40
TSHR P16473 2/20 0.40
HSD17B3 P37058 1/20 0.40

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
Pyridine SCHEMBL4775859 0.93 CHRM5 (0.55) CHRM5CHKAMAPTSMN1; SMN2ALDH1A1
Acetone SCHEMBL28700630 0.87 CHRM5 (0.76) CHRM5CHKAMAPTSMN1; SMN2ALDH1A1
Acetic Acid SCHEMBL7780301 0.85 CHRM5 (0.73) CHRM5CHKAMAPTSMN1; SMN2ALDH1A1
Bicarbonate SCHEMBL9762926 0.83 CHRM5 (0.76) CHRM5CHKAMAPTSMN1; SMN2ALDH1A1
Bicarbonate SCHEMBL28267252 0.81 CHRM5 (0.73) CHRM5CHKAMAPTSMN1; SMN2ALDH1A1
Bicarbonate SCHEMBL28588179 0.81 CHRM5 (0.73) CHRM5CHKAMAPTSMN1; SMN2ALDH1A1
SCHEMBL28166029 0.81 CHRM5 (0.73) CHRM5CHKAMAPTSMN1; SMN2ALDH1A1
Propionic Acid SCHEMBL28433613 0.80 CHRM5 (0.64) CHRM5CHKAMAPTSMN1; SMN2ALDH1A1
SCHEMBL28208758 0.80 CHRM5 (0.64) CHRM5CHKAMAPTSMN1; SMN2ALDH1A1
SCHEMBL189 0.80

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108929334-A A kind of preparation method of morpholine diketone class natural alkaloid and its derivative 中山大学 2018-12-04 CN claimed
JP-63222146-A None JP disclosed
US-10730904-B2 Method for liquid-phase synthesis of nucleic acid TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-08-04 US disclosed
EP-2921499-B1 METHOD FOR LIQUID-PHASE SYNTHESIS OF NUCLEIC ACIDS TAKEDA PHARMACEUTICALS CO (JP) 2020-01-22 EP disclosed
CN-106573904-B Method for generating beraprost and its derivative 朗格生物技术公共公益股份有限公司 2019-11-08 CN disclosed
US-20190135852-A1 METHOD FOR LIQUID-PHASE SYNTHESIS OF NUCLEIC ACID TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-05-09 US disclosed
CN-104918949-B The liquid-phase synthesis process of nucleic acid 武田药品工业株式会社 2017-10-10 CN disclosed
CN-106573904-A Methods for producing beraprost and its derivatives 朗格生物技术公共公益股份有限公司 2017-04-19 CN disclosed
US-20150315229-A1 METHOD FOR LIQUID-PHASE SYNTHESIS OF NUCLEIC ACID TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-11-05 US disclosed
EP-2921499-A1 METHOD FOR LIQUID-PHASE SYNTHESIS OF NUCLEIC ACID Takeda Pharmaceutical Company Limited (JP) 2015-09-23 EP disclosed
US-20030144532-A1 Method of manufacture of 1,3-oxathiolane nucleosides GILEAD SCIENCES, INC. 2003-07-31 US disclosed
WO-2003050095-A1 SUBSTITUTED BENZOXAZOLES AND ANALOGUES AS ESTROGENIC AGENTS WYETH (US) 2003-06-19 WO disclosed
US-6576776-B1 Method of manufacture of 1,3-oxathiolane nucleosides TRIANGLE PHARMACEUTICALS, INC. 2003-06-10 US disclosed
US-6518425-B1 A process for producing a 1,3-oxathiolane nucleoside comprising reacting a 5-halo-2-protected-oxymethyl-1,3-oxathiolane with a silylated purine or pyrimidine without the addition of a Lewis acid or an additional base to the reaction EMORY UNIVERSITY 2003-02-11 US disclosed
EP-1104415-A1 METHOD OF MANUFACTURE OF 1,3-OXATHIOLANE NUCLEOSIDES Triangle Pharmaceuticals Inc. (US) 2001-06-06 EP disclosed
US-6215004-B1 CYCLIZATION OF MERCAPTOACETIC ACID WITH ACETAL IN SOLVENT; SULFIDING EMORY UNIVERSITY 2001-04-10 US disclosed
US-6069132-A PYRIMIDOPHOSOHAZOLE RING SYSTEM OF GIVEN STRUCTURE, THE TRIVALENT PHOSPHORUS OF THE RING SUBSTITUTED WITH VARIOUS GROUPS; NEW CLASS OF PHOSPHORUS CONTAINING HETEROCYCLES WITH APPLICATION IN MEDICAL, AGRICULTURAL AND INDUSTRIAL USE ARONEX PHARMACEUTICALS, INC. 2000-05-30 US disclosed
WO-2000009494-A1 METHOD OF MANUFACTURE OF 1,3-OXATHIOLANE NUCLEOSIDES TRIANGLE PHARMACEUTICALS, INC. (US) 2000-02-24 WO disclosed
JP-S63222146-A CYCLOPENTANONE DERIVATIVE AND PRODUCTION THEREOF NOGUCHI KENKYUSHO 1988-09-16 JP disclosed
EP-0210065-A1 6-Alkylidene penems BEECHAM GROUP PLC (GB) 1987-01-28 EP 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-20150315229-A1 METHOD FOR LIQUID-PHASE SYNTHESIS OF NUCLEIC ACID POLM, POLRMT, RNMT CHRM5 894/4885CHKA 989/4885MAPT 3691/4885
US-20190135852-A1 METHOD FOR LIQUID-PHASE SYNTHESIS OF NUCLEIC ACID RNGTT, POLR2H, POLR2E CHRM5 2598/4885CHKA 3464/4885MAPT 3982/4885
US-20030144532-A1 Method of manufacture of 1,3-oxathiolane nucleosides NUDT1, PNP, TYMP CHRM5 3129/4885CHKA 2815/4885MAPT 3446/4885
US-10730904-B2 Method for liquid-phase synthesis of nucleic acid RNGTT, POLR2H, POLR2E CHRM5 2113/4885CHKA 3481/4885MAPT 4087/4885

“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.