SCHEMBL10215486

SCHEMBL10215486

O=C1COC[C@@H](CO)N1Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 3/20 0.47
EHMT2 Q96KQ7 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
CYP2C19 P33261 3/20 0.39
CYP3A4 P08684 2/20 0.39
TSHR P16473 1/20 0.39
AGTR2 P50052 1/20 0.39
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
CYP2C9 P11712 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
STAT6 P42226 1/20 0.38
FUCA1 P04066 2/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL12495007 1.00 P2RX7 (0.47) P2RX7EHMT2MEN1KMT2ACYP2C19
SCHEMBL12018713 0.85 P2RX7 (0.46) P2RX7EHMT2MEN1KMT2ACYP2C19
SCHEMBL6133023 0.85 P2RX7 (0.45) P2RX7EHMT2MEN1KMT2ATSHR
SCHEMBL6133226 0.85 P2RX7 (0.45) P2RX7EHMT2MEN1KMT2ATSHR
SCHEMBL6132818 0.82 P2RX7 (0.43) P2RX7EHMT2MEN1KMT2AAGTR2
SCHEMBL27278853 0.81 EHMT2 (0.49) EHMT2MEN1KMT2ACYP2C19CYP3A4
SCHEMBL11065983 0.81 EHMT2 (0.49) EHMT2MEN1KMT2ACYP2C19CYP3A4
SCHEMBL20637914 0.81 P2RX7 (0.44) P2RX7EHMT2MEN1KMT2ATSHR
SCHEMBL12018716 0.81 P2RX7 (0.44) P2RX7EHMT2MEN1KMT2ATSHR
SCHEMBL1190522 0.79 P2RX7 (0.58) P2RX7EHMT2MEN1KMT2ACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117466884-A Heterocyclic compounds or salts thereof as ATR kinase inhibitors, pharmaceutical compositions containing same and uses thereof 德州大学系统董事会 2024-01-30 CN disclosed
EP-3651768-B1 HETEROCYCLIC INHIBITORS OF ATR KINASE UNIV TEXAS (US) 2023-12-20 EP disclosed
CN-111867590-B Heterocyclic inhibitors of ATR kinase 德州大学系统董事会 2023-11-17 CN disclosed
US-11434233-B2 Heterocyclic inhibitors of ATR kinase BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-09-06 US disclosed
US-20210047311-A1 HETEROCYCLIC INHIBITORS OF ATR KINASE ARTIOS PHARMA LIMITED (GB) 2021-02-18 US disclosed
US-20210047311-A1 HETEROCYCLIC INHIBITORS OF ATR KINASE ARTIOS PHARMA LIMITED (GB) 2021-02-18 US disclosed
CN-111867590-A Heterocyclic inhibitors of ATR kinase 德州大学系统董事会 2020-10-30 CN disclosed
US-10800769-B2 Heterocyclic inhibitors of ATR kinase BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2020-10-13 US disclosed
US-10800769-B2 Heterocyclic inhibitors of ATR kinase BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2020-10-13 US disclosed
US-20200102296-A1 HETEROCYCLIC INHIBITORS OF ATR KINASE SHANGPHARMA LLC 2020-04-02 US disclosed
WO-2019014618-A1 HETEROCYCLIC INHIBITORS OF ATR KINASE BOARD OF REGENTS, UNIVERSITY OF TEXAS SYSTEM (US) 2019-01-17 WO disclosed
US-20190016713-A1 HETEROCYCLIC INHIBITORS OF ATR KINASE ARTIOS PHARMA LIMITED (GB) 2019-01-17 US disclosed
US-20190016713-A1 HETEROCYCLIC INHIBITORS OF ATR KINASE ARTIOS PHARMA LIMITED (GB) 2019-01-17 US disclosed
US-8940738-B2 Pyrimidone compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-01-27 US disclosed
US-8940738-B2 Pyrimidone compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2015-01-27 US disclosed
US-20120220591-A1 PYRIMIDONE COMPOUNDS SANOFI (FR) 2012-08-30 US disclosed
US-20120220591-A1 PYRIMIDONE COMPOUNDS SANOFI (FR) 2012-08-30 US disclosed
US-20120053148-A1 INHIBITORS OF HEPATITIS C VIRUS GILEAD SCIENCES, INC. (US) 2012-03-01 US disclosed
US-20120053148-A1 INHIBITORS OF HEPATITIS C VIRUS GILEAD SCIENCES, INC. (US) 2012-03-01 US disclosed
WO-2011156610-A2 INHIBITORS OF HEPATITIS C VIRUS GILEAD SCIENCES, INC. (US) 2011-12-15 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 (7 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-20120220591-A1 PYRIMIDONE COMPOUNDS MAPT, PRNP, PSEN1 P2RX7 2862/4885EHMT2 3102/4885MEN1 1876/4885
US-10800769-B2 Heterocyclic inhibitors of ATR kinase ATR, CHEK1, CHEK2 P2RX7 4528/4885EHMT2 2189/4885MEN1 2344/4885
US-20120053148-A1 INHIBITORS OF HEPATITIS C VIRUS HAVCR2, FABP1, EIF2AK2 P2RX7 3918/4885EHMT2 4566/4885MEN1 4882/4885
US-11434233-B2 Heterocyclic inhibitors of ATR kinase ATR, CHEK1, CHEK2 P2RX7 4528/4885EHMT2 2189/4885MEN1 2344/4885
US-20200102296-A1 HETEROCYCLIC INHIBITORS OF ATR KINASE ATR, CHEK1, CHEK2 P2RX7 4528/4885EHMT2 2189/4885MEN1 2344/4885
US-20190016713-A1 HETEROCYCLIC INHIBITORS OF ATR KINASE ATR, CHEK1, CHEK2 P2RX7 4528/4885EHMT2 2189/4885MEN1 2344/4885
US-20210047311-A1 HETEROCYCLIC INHIBITORS OF ATR KINASE ATR, CHEK1, CHEK2 P2RX7 4528/4885EHMT2 2189/4885MEN1 2344/4885

“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.