Lomustine

Lomustine

SCHEMBL868328

O=NN(CCCl)C(=O)NC1CCCCC1.O=NN(CCCl)C(=O)NC1CCCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 1.00
PDE4A P27815 1/20 1.00
ADRA1A P35348 1/20 1.00
ALDH1A1 P00352 4/20 0.75
SMN1; SMN2 Q16637 4/20 0.75
KMT2A Q03164 3/20 0.53
MEN1 O00255 1/20 0.53
ABCB11 O95342 1/20 0.53
GSR P00390 1/20 0.53
TSHR P16473 1/20 0.53
HTT P42858 1/20 0.53
BLM P54132 1/20 0.53
PMP22 Q01453 1/20 0.53
EPHX1 P07099 7/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
EPHX2 P34913 2/20 0.42
MAPT P10636 1/20 0.42
KDM4E B2RXH2 1/20 0.42
CYP3A4 P08684 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
Lomustine SCHEMBL3995 1.00 ADRA2A (1.00) ADRA2APDE4AADRA1AALDH1A1SMN1; SMN2
Lomustine SCHEMBL28262197 0.97 ADRA2A (0.94) ADRA2APDE4AADRA1AALDH1A1SMN1; SMN2
Lomustine SCHEMBL28159683 0.95 ADRA2A (0.91) ADRA2APDE4AADRA1AALDH1A1SMN1; SMN2
Lomustine SCHEMBL28123007 0.95 ADRA2A (0.91) ADRA2APDE4AADRA1AALDH1A1SMN1; SMN2
Lomustine SCHEMBL1831239 0.93 ADRA2A (0.86) ADRA2APDE4AADRA1AALDH1A1SMN1; SMN2
Semustine SCHEMBL2350016 0.91 ALDH1A1 (0.92) ADRA2APDE4AADRA1AALDH1A1SMN1; SMN2
Lomustine SCHEMBL863570 0.91 ADRA2A (0.83) ADRA2APDE4AADRA1AALDH1A1SMN1; SMN2
SCHEMBL4634654 0.88 ADRA2A (0.79) ADRA2APDE4AADRA1AALDH1A1SMN1; SMN2
SCHEMBL3341311 0.87 ADRA2A (0.77) ADRA2APDE4AADRA1AALDH1A1SMN1; SMN2
SCHEMBL3341308 0.87 ADRA2A (0.77) ADRA2APDE4AADRA1AALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220202950-A1 COMPOSITIONS COMPRISING BACTERIALLY DERIVED INTACT MINICELLS FOR THERANOSTIC APPLICATIONS ENGENEIC MOLECULAR DELIVERY PTY LTD (AU) 2022-06-30 US claimed
EP-4010072-A2 TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS KNOW Bio, LLC (US) 2022-06-15 EP claimed
CN-114206435-A Treatment of central nervous system disorders 诺欧生物有限责任公司 2022-03-18 CN claimed
WO-2021026218-A2 TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS KNOW BIO, LLC (US) 2021-02-11 WO claimed
WO-2020222161-A1 COMPOSITIONS COMPRISING BACTERIALLY DERIVED INTACT MINICELLS FOR THERANOSTIC APPLICATIONS ENGENEIC MOLECULAR DELIVERY PTY LTD (AU) 2020-11-05 WO claimed
US-20180298109-A1 POLYPEPTIDES AND POLYNUCLEOTIDES, AND USES THEREOF AS A DRUG TARGET FOR PRODUCING DRUGS AND BIOLOGICS COMPUGEN LTD (IL) 2018-10-18 US claimed
US-20170037141-A1 POLYPEPTIDES AND POLYNUCLEOTIDES, AND USES THEREOF AS A DRUG TARGET FOR PRODUCING DRUGS AND BIOLOGICS COMPUGEN LTD. (IL) 2017-02-09 US claimed
US-20160244457-A1 SELECTIVE EFFLUX INHIBITORS AND RELATED PHARMACEUTICAL COMPOSITIONS AND METHODS OF TREATMENT UNIV KANSAS (US) 2016-08-25 US claimed
US-20150197526-A1 SELECTIVE EFFLUX INHIBITORS AND RELATED PHARMACEUTICAL COMPOSITIONS AND METHODS OF TREATMENT UNIVERSITY OF KANSAS 2015-07-16 US claimed
WO-2012058269-A2 METHODS OF TREATING CANCER AND OTHER DISEASES THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2012-05-03 WO claimed
US-20090208493-A1 Compounds and methods for the selective inhibition of ABCB1, ABCC1 and ABCG2 transporters and the treatment of cancers, especially drug resistant cancers and high throughput flow cytometry assay to detect selective inhibitors STC. UNM (US) 2009-08-20 US claimed
WO-2009070331-A2 COMPOUNDS AND METHODS FOR THE SELECTIVE INHIBITION OF ABCB1, ABCC1 AND ABCG2 TRANSPORTERS AND THE TREATMENT OF CANCERS, ESPECIALLY DRUG RESISTANT CANCERS AND HIGH THROUGHPUT FLOW CYTOMETRY ASSAY TO DETECT SELECTIVE INHIBITORS STC.UNM (US) 2009-06-04 WO claimed
US-20070185069-A1 Anti-angiogenic activity of 2-methoxyestradiol in combination with anti-cancer agents ENTREMED, INC. 2007-08-09 US claimed
WO-2007059111-A2 ANTI-ANGIOGENIC ACTIVITY OF 2-METHOXYESTRADIOL IN COMBINATION WITH ANTI-CANCER AGENTS ENTREMED, INC. (US) 2007-05-24 WO claimed
CN-118317947-A Sortilin inhibitors 索蒂纳制药股份有限公司 2024-07-09 CN disclosed
US-11964021-B2 Bacterially derived, intact minicells for delivery of therapeutic agents to brain tumors ENGENELC MOLECULAR DELIVERY PTY LTD (AU) 2024-04-23 US disclosed
WO-2023101595-A1 SORTILIN INHIBITORS SORTINA PHARMA AB (SE) 2023-06-08 WO disclosed
EP-0739419-B1 METHODS OF ASSAYING DNA-REPAIRING ENZYMES AND THEIR ALKYLATED DERIVATIVES INST OF MOLECUL & CELL BIOLOGY (SG) 1999-04-07 EP disclosed
EP-0739419-A1 METHODS OF ASSAYING DNA-REPAIRING ENZYMES AND THEIR ALKYLATED DERIVATIVES NATIONAL UNIVERSITY OF SINGAPORE (SG) 1996-10-30 EP disclosed
WO-1995019445-A1 METHODS OF ASSAYING DNA-REPAIRING ENZYMES AND THEIR ALKYLATED DERIVATIVES NATIONAL UNIVERSITY OF SINGAPORE (SG) 1995-07-20 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 (3 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-20150197526-A1 SELECTIVE EFFLUX INHIBITORS AND RELATED PHARMACEUTICAL COMPOSITIONS AND METHODS OF TREATMENT ABCB1, ABCG2, ABCC5 ADRA2A 1394/4885PDE4A 2323/4885ADRA1A 1011/4885
US-20070185069-A1 Anti-angiogenic activity of 2-methoxyestradiol in combination with anti-cancer agents VEGFA, PGF, MKI67 ADRA2A 792/4885PDE4A 1360/4885ADRA1A 914/4885
US-20160244457-A1 SELECTIVE EFFLUX INHIBITORS AND RELATED PHARMACEUTICAL COMPOSITIONS AND METHODS OF TREATMENT ABCB1, ABCG2, ABCC5 ADRA2A 1394/4885PDE4A 2323/4885ADRA1A 1011/4885

“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.