SCHEMBL4404326

SCHEMBL4404326

Oc1c(Cl)cc(Br)cc1/C=N/Nc1ncc(F)c(N2CCNCC2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 1/20 0.50
▸ RAB9A P51151 4/20 0.49
▸ HTT P42858 3/20 0.49
▸ NPC1 O15118 3/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ MITF O75030 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ MAPT P10636 9/20 0.44
▸ KMT2A Q03164 9/20 0.44
▸ MEN1 O00255 8/20 0.44
▸ KDM4E B2RXH2 6/20 0.44
▸ NPSR1 Q6W5P4 4/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ GAA P10253 2/20 0.41
▸ LMNA P02545 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HKDC1 Q2TB90 1/20 0.35
▸ KDM4C Q9H3R0 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL4405047 0.91 KDM5A (0.52) KDM5ARAB9AHTTNPC1SMN1; SMN2
SCHEMBL4411838 0.89 KDM5A (0.65) KDM5ARAB9AHTTNPC1SMN1; SMN2
SCHEMBL20859535 0.89 KDM5A (0.50) KDM5ARAB9AHTTNPC1SMN1; SMN2
SCHEMBL13548896 0.89 KDM5A (0.65) KDM5ARAB9AHTTNPC1SMN1; SMN2
SCHEMBL19862523 0.81 RAB9A (0.46) RAB9AHTTNPC1SMN1; SMN2MITF
SCHEMBL13550629 0.80 KDM5A (0.65) KDM5ARAB9AHTTNPC1SMN1; SMN2
SCHEMBL13548902 0.79 KDM5A (0.67) KDM5ARAB9AHTTNPC1SMN1; SMN2
SCHEMBL13548874 0.79 KDM5A (0.60) KDM5ARAB9AHTTNPC1SMN1; SMN2
SCHEMBL13548899 0.79 KDM5A (0.60) KDM5ARAB9AHTTNPC1SMN1; SMN2
SCHEMBL14045958 0.78 KDM5A (0.65) KDM5ARAB9AHTTNPC1SMN1; 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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11839617-B2 Theramutein modulators HMI Medical Innovations, LLC (US) 2023-12-12 — — US disclosed
US-11839617-B2 Theramutein modulators HMI Medical Innovations, LLC (US) 2023-12-12 — — US disclosed
US-11714080-B2 Compounds and methods of identifying, synthesizing, optimizing and profiling protein modulators HMI Medical Innovations, LLC (US) 2023-08-01 — — US disclosed
US-11714080-B2 Compounds and methods of identifying, synthesizing, optimizing and profiling protein modulators HMI Medical Innovations, LLC (US) 2023-08-01 — — US disclosed
US-11692998-B2 Compounds and methods of identifying, synthesizing, optimizing and profiling protein modulators HMI Medical Innovations, LLC (US) 2023-07-04 — — US disclosed
US-11692998-B2 Compounds and methods of identifying, synthesizing, optimizing and profiling protein modulators HMI Medical Innovations, LLC (US) 2023-07-04 — — US disclosed
US-20210015825-A1 THERAMUTEIN MODULATORS HMI Medical Innovations, LLC 2021-01-21 — — US disclosed
US-20210008077-A1 THERAMUTEIN MODULATORS HMI Medical Innovations, LLC 2021-01-14 — — US disclosed
US-10806738-B2 Theramutein modulators HMI Medical Innovations, LLC (US) 2020-10-20 — — US disclosed
US-20200046718-A1 THERAMUTEIN MODULATORS HMI Medical Innovations, LLC 2020-02-13 — — US disclosed
EP-2447252-A2 Theramutein modulators Housey, Gerard M. (US) 2012-05-02 — — EP disclosed
US-20100016298-A1 Theramutein modulators HOUSEY GERAD M 2010-01-21 — — US disclosed
US-20100016298-A1 Theramutein modulators HOUSEY GERAD M 2010-01-21 — — US disclosed
US-20090275070-A1 Compounds and Methods of Identifying, Synthesizing, Optimizing and Profiling Protein Modulators HOUSEY GERARD M 2009-11-05 — — US disclosed
US-20090275070-A1 Compounds and Methods of Identifying, Synthesizing, Optimizing and Profiling Protein Modulators HOUSEY GERARD M 2009-11-05 — — US disclosed
US-20080269262-A1 Blocking or activation of endogenous proteins variations rncoded by mutated gees HMI MEDICAL INNOVATIONS, LLC. 2008-10-30 — — US disclosed
US-20080269262-A1 Blocking or activation of endogenous proteins variations rncoded by mutated gees HMI MEDICAL INNOVATIONS, LLC. 2008-10-30 — — US disclosed
WO-2008091681-A2 THERAMUTEIN MODULATORS HOUSEY GERARD M (US) 2008-07-31 — — WO disclosed
US-20070111199-A1 Compounds and method of identifying, synthesizing, optimizing and profiling protein modulators HMI Medical Innovations, LLC 2007-05-17 — — US disclosed
US-20070111199-A1 Compounds and method of identifying, synthesizing, optimizing and profiling protein modulators HMI Medical Innovations, LLC 2007-05-17 — — 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-20210008077-A1 THERAMUTEIN MODULATORS TSG101, SERPINE1, PLAUR KDM5A 4434/4885RAB9A 2031/4885HTT 1926/4885
US-20100016298-A1 Theramutein modulators TSG101, SERPINE1, PLAUR KDM5A 4434/4885RAB9A 2031/4885HTT 1926/4885
US-20210015825-A1 THERAMUTEIN MODULATORS TSG101, SERPINE1, PLAUR KDM5A 4434/4885RAB9A 2031/4885HTT 1926/4885
US-10806738-B2 Theramutein modulators TSG101, SERPINE1, PLAUR KDM5A 4434/4885RAB9A 2031/4885HTT 1926/4885
US-11839617-B2 Theramutein modulators TSG101, SERPINE1, PLAUR KDM5A 4434/4885RAB9A 2031/4885HTT 1926/4885
US-20200046718-A1 THERAMUTEIN MODULATORS TSG101, SERPINE1, PLAUR KDM5A 4434/4885RAB9A 2031/4885HTT 1926/4885
US-20080269262-A1 Blocking or activation of endogenous proteins variations rncoded by mutated gees SERBP1, SERPINA6, UBE2V1 KDM5A 3794/4885RAB9A 1721/4885HTT 2810/4885

“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.

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