SCHEMBL497431

SCHEMBL497431

O=c1ccnc(N2CCOCC2)[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DCTPP1 Q9H773 1/20 0.48
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
TSHR P16473 2/20 0.47
HSD17B10 Q99714 1/20 0.47
CDC7 O00311 1/20 0.46
DBF4 Q9UBU7 1/20 0.46
PIK3CA P42336 3/20 0.46
PIK3CB P42338 3/20 0.46
TP53 P04637 1/20 0.44
GAA P10253 1/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
PIK3C3 Q8NEB9 2/20 0.41
ALDH1A1 P00352 1/20 0.41
PIK3CD O00329 1/20 0.41
MAPK1 P28482 1/20 0.41
XDH P47989 1/20 0.40
LRRK2 Q5S007 1/20 0.40
ATM Q13315 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
SCHEMBL803675 0.84 HSD17B10 (0.46) KMT2AMEN1HSD17B10POLBSMN1; SMN2
SCHEMBL7835747 0.82 HSD17B10 (0.49) KMT2AMEN1TSHRHSD17B10TP53
SCHEMBL1129663 0.81 HRH3 (0.44) HSD17B10ALDH1A1
SCHEMBL2524274 0.74 KMT2A (0.44) KMT2AMEN1TSHRHSD17B10PIK3CA
SCHEMBL30677309 0.73 PIK3CA (0.43) KMT2AMEN1TSHRHSD17B10PIK3CA
SCHEMBL16423097 0.73 MAPK10 (0.49) TP53GAASMN1; SMN2MAPK1
SCHEMBL26130480 0.72 PIK3CB (0.43) KMT2AMEN1TSHRHSD17B10CDC7
SCHEMBL30677461 0.72 PIK3CA (0.41) KMT2AMEN1TSHRHSD17B10CDC7
SCHEMBL20606156 0.72 KMT2A (0.41) KMT2ATSHRHSD17B10PIK3CAPIK3CB
SCHEMBL6904489 0.71 TP53 (0.45) KMT2AMEN1TSHRHSD17B10PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10835524-B2 Compositions for the treatment of pancreatic cancer and uses thereof UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2020-11-17 US claimed
US-8129377-B2 6-(pyridinyl)-4-pyrimidone derivates as tau protein kinase 1 inhibitors MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-03-06 US claimed
CN-107721937-B Preparation method and application of compound containing pyrimidone skeleton 沈阳药科大学 2021-02-05 CN disclosed
US-9763900-B2 Chemical chaperonins as novel molecular modulators of beta protein aggregation present in conformational diseases CENTRO DE NEUROCIENCIAS DE CUBA (CU) 2017-09-19 US disclosed
US-20160106691-A1 CHEMICAL CHAPERONINS AS NOVEL MOLECULAR MODULATORS OF BETA PROTEIN AGGREGATION PRESENT IN CONFORMATIONAL DISEASES CENTRO DE NEUROCIENCIAS DE CUBA (NEURONIC) (CU) 2016-04-21 US disclosed
CN-102548970-B Novel (6-oxo-1, 6-dihydropyrimidin-2-yl) amide derivatives, process for their preparation and their medical use as akt (pkb) phosphorylation inhibitors SAI NUOFEI (FR) 2015-11-25 CN disclosed
CN-102482286-B Novel 1,2,3, 4-tetrahydropyrimidino {1,2-a } pyrimidin-6-one derivatives, their preparation and their medical use SANOFI SA 2015-07-15 CN disclosed
CN-102482285-B Novel 2,3-dihydro-1h-imidazo(1,2-a)pyrimidin-5-one derivatives, preparation thereof, and pharmaceutical use thereof SANOFI SA 2015-07-15 CN disclosed
EP-2097409-B1 2-SUBSTITUTED-6-HETEROCYCLIC PYRIMIDONE DERIVATIVES AS TAU PROTEIN KINASE 1 INHBITORS MITSUBISHI TANABE PHARMA CORP (JP) 2012-09-12 EP disclosed
CN-102548970-A Novel (6-oxo-1, 6-dihydropyrimidin-2-yl) amide derivatives, process for their preparation and their medical use as akt (pkb) phosphorylation inhibitors SANOFI AVENTIS 2012-07-04 CN disclosed
CN-102482285-A Novel 2, 3-dihydro-1H-imidazo {1,2-a } pyrimidin-5-one derivatives, their preparation and their pharmaceutical use SANOFI AVENTIS 2012-05-30 CN disclosed
CN-102482286-A Novel 1,2,3, 4-tetrahydropyrimidino {1,2-a } pyrimidin-6-one derivatives, their preparation and their medical use SANOFI SA 2012-05-30 CN disclosed
US-8106045-B2 2-morpholino-4-pyrimidone compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-01-31 US disclosed
EP-2266979-A1 2-morpholino-4-pyrimidone compounds Mitsubishi Tanabe Pharma Corporation (JP) 2010-12-29 EP disclosed
EP-2258701-A1 2-morpholino-4-pyrimidone compound Mitsubishi Tanabe Pharma Corporation (JP) 2010-12-08 EP disclosed
CN-101035781-A 2-morpholino-4-pyrimidone compound MITSUBISHI PHARMA CORP (JP) 2007-09-12 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 (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-10835524-B2 Compositions for the treatment of pancreatic cancer and uses thereof PIK3CA, MTOR, PIK3CD DCTPP1 4204/4885KMT2A 965/4885MEN1 39/4885
US-20160106691-A1 CHEMICAL CHAPERONINS AS NOVEL MOLECULAR MODULATORS OF BETA PROTEIN AGGREGATION PRESENT IN CONFORMATIONAL DISEASES HSPA2, HSPB1, HSP90AB2P DCTPP1 4581/4885KMT2A 4306/4885MEN1 4570/4885

“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.