SCHEMBL4033699

SCHEMBL4033699

O=C(COc1ccc(Cl)cc1)NC1CCNCC1

nearest known ligand 0.81

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ATF4 P18848 5/20 0.81
LMNA P02545 1/20 0.59
KMT2A Q03164 1/20 0.56
ALDH1A1 P00352 1/20 0.54
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.52
RAB9A P51151 1/20 0.52
NPC1 O15118 1/20 0.52

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
Hydrochloric Acid SCHEMBL19692584 0.99 ATF4 (0.79) ATF4LMNAKMT2AALDH1A1HPGD
SCHEMBL16082988 0.90 ATF4 (1.00) ATF4LMNAKMT2AALDH1A1HPGD
SCHEMBL16082980 0.90 ATF4 (1.00) ATF4LMNAKMT2AALDH1A1HPGD
SCHEMBL16083047 0.90 ATF4 (1.00) ATF4LMNAKMT2AALDH1A1HPGD
SCHEMBL25538362 0.86 LMNA (0.59) ATF4LMNAKMT2AHPGDHTT
SCHEMBL19134217 0.86 ATF4 (0.86) ATF4LMNAKMT2AALDH1A1HPGD
SCHEMBL5123998 0.86 POLB (0.62) ATF4LMNAKMT2AALDH1A1HPGD
SCHEMBL19692630 0.85 ATF4 (0.59) ATF4LMNAKMT2AALDH1A1HPGD
SCHEMBL17658630 0.84 ATF4 (0.89) ATF4LMNAKMT2AALDH1A1HPGD
SCHEMBL17658580 0.84 ATF4 (0.89) ATF4LMNAKMT2AALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230165848-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-06-01 US disclosed
US-20230165848-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-06-01 US disclosed
US-20230165848-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-06-01 US disclosed
US-11547704-B2 Chemical compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-01-10 US disclosed
EP-3468960-B1 CHEMICAL COMPOUNDS AS ATF4 PATHWAY INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2022-03-23 EP disclosed
CN-109563071-B Chemical compounds as inhibitors of the ATF4pathway 葛兰素史密斯克莱知识产权发展有限公司 2021-08-03 CN disclosed
US-20200297710-A1 Chemical Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-09-24 US disclosed
US-20190298705-A1 Chemical Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-10-03 US disclosed
EP-3468960-A1 CHEMICAL COMPOUNDS AS ATF4 PATHWAY INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2019-04-17 EP disclosed
CN-109563071-A Chemical compound as ATF4 approach restrainer 葛兰素史密斯克莱知识产权发展有限公司 2019-04-02 CN disclosed
WO-2017212425-A1 CHEMICAL COMPOUNDS AS ATF4 PATHWAY INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-12-14 WO disclosed
WO-2017212425-A1 CHEMICAL COMPOUNDS AS ATF4 PATHWAY INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-12-14 WO disclosed
EP-1212299-B1 SUBSTITUTED PIPERIDINE COMPOUNDS USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ASTRAZENECA UK LTD (GB) 2009-04-08 EP disclosed
US-20050250792-A1 Substituted piperidine compounds useful as modulators of chemokine receptor activity MERRILL LYNCH CAPITAL, A DIVISION OF MERRILL LYNCH BUSINESS FINANCIAL SERVICES, INC. AS ADMINISTRATIVE AGENT 2005-11-10 US disclosed
US-6903085-B1 Substituted piperidine compounds useful as modulators of chemokine receptor activity ASTRAZENECA, AB (CH) 2005-06-07 US disclosed
EP-1212299-A1 SUBSTITUTED PIPERIDINE COMPOUNDS USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY AstraZeneca UK Limited (GB) 2002-06-12 EP disclosed
WO-2001014333-A1 SUBSTITUTED PIPERIDINE COMPOUNDS USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ASTRAZENECA UK LIMITED (GB) 2001-03-01 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 (5 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-20190298705-A1 Chemical Compounds ATF4, XBP1, EIF2B5 ATF4 1/4885LMNA 476/4885KMT2A 3591/4885
US-20200297710-A1 Chemical Compounds ATF4, XBP1, EIF2B5 ATF4 1/4885LMNA 476/4885KMT2A 3591/4885
US-20050250792-A1 Substituted piperidine compounds useful as modulators of chemokine receptor activity CXCR4, CXCR1, CXCR3 ATF4 893/4885LMNA 3126/4885KMT2A 2580/4885
US-20230165848-A1 CHEMICAL COMPOUNDS ATF4, XBP1, EIF2B5 ATF4 1/4885LMNA 470/4885KMT2A 3707/4885
US-11547704-B2 Chemical compounds ATF4, XBP1, EIF2B5 ATF4 1/4885LMNA 476/4885KMT2A 3591/4885

“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.