SCHEMBL3170487

SCHEMBL3170487

CSc1ncc(O)c(O)n1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
MAPK1 P28482 1/20 0.37
NTRK1 P04629 1/20 0.36
ALDH1A1 P00352 2/20 0.33
AHR P35869 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 1/20 0.33
HASPIN Q8TF76 1/20 0.33
POLB P06746 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL3966185 0.80 MEN1 (0.42) MEN1KMT2ANTRK1ALDH1A1AHR
SCHEMBL10997608 0.78 MEN1 (0.41) MEN1KMT2AMAPK1NTRK1ALDH1A1
SCHEMBL1184146 0.78 KMT2A (0.58) MEN1KMT2ANTRK1ALDH1A1AHR
SCHEMBL19725082 0.78 MEN1 (0.49) MEN1KMT2AMAPK1NTRK1ALDH1A1
SCHEMBL4775824 0.78 MEN1 (0.41) MEN1KMT2AMAPK1NTRK1ALDH1A1
SCHEMBL31544394 0.78 MEN1 (0.41) MEN1KMT2AMAPK1NTRK1ALDH1A1
SCHEMBL16083961 0.75 MEN1 (0.39) MEN1KMT2AMAPK1NTRK1ALDH1A1
SCHEMBL170064 0.75 KDM4E (0.44) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL17156365 0.75 MEN1 (0.42) MEN1KMT2ANTRK1ALDH1A1MAPT
SCHEMBL46639 0.74 MEN1 (0.53) MEN1KMT2ANTRK1ALDH1A1AHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101747283-B Method for preparing 4,6 - dimethoxy -2 - methanesulfonyl pyrimidine SHENYANG RES INST CHEMICAL IND 2011-06-08 CN claimed
CN-101747283-A Method for preparing 4,6 - dimethoxy -2 - methanesulfonyl pyrimidine SHENYANG RES INST CHEMICAL IND 2010-06-23 CN claimed
CN-109851565-A A kind of preparation method of the chloro- 2- methylthiopyrimidine of 4,6- bis- 苏州华诺医药有限公司 2019-06-07 CN disclosed
CN-105026376-B Process for the preparation of bispyribac-sodium and intermediates thereof 加尔达化学有限公司 2018-05-11 CN disclosed
CN-104703990-B Macrocyclic purines for the treatment of viral infections 爱尔兰詹森科学公司 2017-10-13 CN disclosed
CN-101747283-B Method for preparing 4,6 - dimethoxy -2 - methanesulfonyl pyrimidine SHENYANG RES INST CHEMICAL IND 2011-06-08 CN disclosed
CN-101747283-A Method for preparing 4,6 - dimethoxy -2 - methanesulfonyl pyrimidine SHENYANG RES INST CHEMICAL IND 2010-06-23 CN disclosed
US-20100008874-A1 SUBSTITUTED PYRIMIDINES, PROCESS FOR THEIR PRODUCTION AND THEIR USE AS EFFECTIVE ABSORBENTS OF UV IRRADIATION YISSUM RESEARCH DEVELOPMENT COMPANY (IL) 2010-01-14 US disclosed
CN-100482664-C 1,5-disubstituted-3,4-dihydro-1H-pyrimido [4,5-D] pyrimidi-2-one compounds and their use in treating CSBP/P38 kinase mediated diseases SMITHKLINE BEECHAM CORP (US) 2009-04-29 CN disclosed
CN-1422273-A 1,5-disubstituted-3,4-dihydro-1H-pyrimido [4,5-D] pyrimidi-2-one compounds and their use in treating CSBP/P38 kinase mediated diseases SMITHKLINE BEECHAM CORP (US) 2003-06-04 CN disclosed
CN-1396158-A Process for synthesizing 4,6-dimethoxy-2-methiopyrimidine UNIV ZHEJIANG POLYTECHNIC (CN) 2003-02-12 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 (1 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-20100008874-A1 SUBSTITUTED PYRIMIDINES, PROCESS FOR THEIR PRODUCTION AND THEIR USE AS EFFECTIVE ABSORBENTS OF UV IRRADIATION UNG, UMPS, TYMP MEN1 3516/4885KMT2A 3462/4885MAPK1 4310/4885

“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.