SCHEMBL3098692

SCHEMBL3098692

CCOC(=O)c1cnc(OC)nc1Cl

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.55
KDM4E B2RXH2 3/20 0.55
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
HSP90AA1 P07900 1/20 0.46
DPP4 P27487 3/20 0.45
MAPT P10636 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 2/20 0.44
MAPK1 P28482 1/20 0.44
ATM Q13315 1/20 0.44
GAA P10253 2/20 0.43
NPC1 O15118 1/20 0.43
TP53 P04637 1/20 0.43
RAB9A P51151 1/20 0.43
CSNK1D P48730 1/20 0.43
TSHR P16473 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL31467093 1.00 ALDH1A1 (0.55) ALDH1A1KDM4EKMT2AMEN1HSP90AA1
SCHEMBL11098691 0.89 ALDH1A1 (0.56) ALDH1A1KDM4EKMT2AMEN1HSP90AA1
SCHEMBL11597406 0.83 HSP90AA1 (0.47) ALDH1A1KDM4EKMT2AMEN1HSP90AA1
SCHEMBL26984412 0.83 ALDH1A1 (0.51) ALDH1A1KDM4EKMT2AMEN1HSP90AA1
SCHEMBL427402 0.83 ALDH1A1 (0.63) ALDH1A1KDM4EKMT2AMEN1HSP90AA1
SCHEMBL476310 0.83 ALDH1A1 (0.59) ALDH1A1KDM4EKMT2AMEN1HSP90AA1
SCHEMBL29922173 0.83 ALDH1A1 (0.59) ALDH1A1KDM4EKMT2AMEN1HSP90AA1
SCHEMBL11083717 0.82 SMN1; SMN2 (0.59) ALDH1A1KDM4EHSP90AA1MAPTSMN1; SMN2
SCHEMBL8738554 0.81 KDM4E (0.61) ALDH1A1KDM4EKMT2AMEN1HSP90AA1
SCHEMBL14638064 0.81 HSP90AA1 (0.67) ALDH1A1KDM4EKMT2AMEN1HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4125720-A Process for the preparation of 4-chloro-5-alkoxycarbonyl-2-methoxy-pyrimidines LABORATOIRE ROGER BELLON (FR) 1978-11-14 US claimed
US-20250197421-A1 MCL1 INHIBITORS GILEAD SCIENCES, INC. 2025-06-19 US disclosed
US-12202842-B2 MCL1 inhibitors GILEAD SCIENCES, INC. (US) 2025-01-21 US disclosed
CN-114867530-B MCL1 inhibitors 吉利德科学公司 2024-08-16 CN disclosed
US-20230348494-A1 MCL1 INHIBITORS GILEAD SCIENCES, INC. 2023-11-02 US disclosed
US-20230348494-A1 MCL1 INHIBITORS GILEAD SCIENCES, INC. 2023-11-02 US disclosed
US-11667652-B2 MCL1 inhibitors GILEAD SCIENCES, INC. (US) 2023-06-06 US disclosed
US-11667652-B2 MCL1 inhibitors GILEAD SCIENCES, INC. (US) 2023-06-06 US disclosed
US-11667652-B2 MCL1 inhibitors GILEAD SCIENCES, INC. (US) 2023-06-06 US disclosed
US-20220348571-A1 DIHYDROPYRIMIDINE DERIVATIVES AND USES THEREOF IN THE TREATMENT OF HBV INFECTION OR OF HBV-INDUCED DISEASES JANSSEN SCIENCES IRELAND UNLIMITED CO (US) 2022-11-03 US disclosed
WO-2014058747-A1 5-PHENOXY-3H-PYRIMIDIN-4-ONE DERIVATIVES AND THEIR USE AS HIV REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-04-17 WO disclosed
WO-2014058747-A1 5-PHENOXY-3H-PYRIMIDIN-4-ONE DERIVATIVES AND THEIR USE AS HIV REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-04-17 WO disclosed
US-20140100231-A1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME LLC 2014-04-10 US disclosed
EP-2143724-B1 NITROGENATED FUSED RING DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME, AND USE OF THE SAME FOR MEDICAL PURPOSES KISSEI PHARMACEUTICAL (JP) 2013-12-11 EP disclosed
CN-101663302-B Nitrogenated fused ring derivative, pharmaceutical composition comprising the same, and use of the same for medical purposes KISSEI PHARMACEUTICAL 2013-07-24 CN disclosed
US-8217069-B2 Nitrogenated fused ring derivative, pharmaceutical composition comprising the same, and use of the same for medical purposes KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-07-10 US disclosed
US-20100112090-A1 NITROGENATED FUSED RING DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME, AND USE OF THE SAME FOR MEDICAL PURPOSES KISSEI PHARMACEUTICAL CO., LTD (JP) 2010-05-06 US disclosed
CN-101663302-A Nitrogenated fused ring derivative, pharmaceutical composition comprising the same, and use of the same for medical purposes KISSEI PHARMACEUTICAL 2010-03-03 CN disclosed
EP-2143724-A1 NITROGENATED FUSED RING DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME, AND USE OF THE SAME FOR MEDICAL PURPOSES Kissei Pharmaceutical Co., Ltd. (JP) 2010-01-13 EP disclosed
US-4125720-A Process for the preparation of 4-chloro-5-alkoxycarbonyl-2-methoxy-pyrimidines LABORATOIRE ROGER BELLON (FR) 1978-11-14 US 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-20220348571-A1 DIHYDROPYRIMIDINE DERIVATIVES AND USES THEREOF IN THE TREATMENT OF HBV INFECTION OR OF HBV-INDUCED DISEASES DPYD, HAVCR2, TYMP ALDH1A1 1223/4885KDM4E 3791/4885KMT2A 3463/4885
US-12202842-B2 MCL1 inhibitors MCL1, BCL2L1, BCLAF1 ALDH1A1 887/4885KDM4E 2654/4885KMT2A 2671/4885
US-20230348494-A1 MCL1 INHIBITORS MCL1, BCL2L1, BCLAF1 ALDH1A1 946/4885KDM4E 2717/4885KMT2A 2686/4885
US-20140100231-A1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS POLRMT, POLR2E, RTF1 ALDH1A1 1343/4885KDM4E 1082/4885KMT2A 580/4885
US-20100112090-A1 NITROGENATED FUSED RING DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME, AND USE OF THE SAME FOR MEDICAL PURPOSES NR5A1, SHBG, GNRHR ALDH1A1 3357/4885KDM4E 1594/4885KMT2A 2609/4885
US-20250197421-A1 MCL1 INHIBITORS MCL1, BCL2L1, BCLAF1 ALDH1A1 946/4885KDM4E 2717/4885KMT2A 2686/4885
US-11667652-B2 MCL1 inhibitors MCL1, BCL2L1, BCLAF1 ALDH1A1 946/4885KDM4E 2717/4885KMT2A 2686/4885

“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.