SCHEMBL4904983

SCHEMBL4904983

CCCCOCC[N+]1(C)CCCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
TSHR P16473 2/20 0.41
LMNA P02545 2/20 0.39
APOBEC3A P31941 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
BBOX1 O75936 2/20 0.38
CHRNB2 P17787 3/20 0.37
CHRNB4 P30926 3/20 0.37
CHRNA3 P32297 3/20 0.37
CHRNA7 P36544 3/20 0.37
CHRNA4 P43681 3/20 0.37
CHRNA10 Q9GZZ6 3/20 0.37
CHRNA9 Q9UGM1 3/20 0.37
CDC25A P30304 2/20 0.36
CYP3A4 P08684 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 2/20 0.35
GNAI3 P08754 1/20 0.35
GNAO1 P09471 1/20 0.35
GNAI1 P63096 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
SCHEMBL4901140 0.98 KDM4E (0.53) KDM4ETSHRLMNAAPOBEC3AAPOBEC3G
Iodide SCHEMBL8914236 0.90 KDM4E (0.50) KDM4ELMNAAPOBEC3AAPOBEC3GBBOX1
SCHEMBL319566 0.87 KDM4E (0.54) KDM4ETSHRLMNAAPOBEC3AAPOBEC3G
SCHEMBL16674108 0.87 KDM4E (0.62) KDM4ETSHRLMNAAPOBEC3AAPOBEC3G
SCHEMBL4903008 0.85 KDM4E (0.57) KDM4ELMNAAPOBEC3AAPOBEC3GBBOX1
SCHEMBL19226284 0.84 KDM4E (0.60) KDM4ETSHRLMNAAPOBEC3AAPOBEC3G
Hydrochloric Acid SCHEMBL29716147 0.84 KDM4E (0.60) KDM4ETSHRLMNAAPOBEC3AAPOBEC3G
SCHEMBL19695887 0.84 KDM4E (0.60) KDM4ETSHRLMNAAPOBEC3AAPOBEC3G
SCHEMBL4902014 0.82 GNAI3 (0.46) KDM4ETSHRCDC25ACYP3A4SMN1; SMN2
Iodide SCHEMBL8916069 0.82 LMNA (0.50) KDM4ETSHRLMNAAPOBEC3AAPOBEC3G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210388015-A1 GLUCOPYRANOSE DERIVATIVES USEFUL AS SGLT2 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2021-12-16 US disclosed
US-20210388016-A1 GLUCOPYRANOSE DERIVATIVES USEFUL AS SGLT2 INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2021-12-16 US disclosed
EP-1867667-B1 Method for manufacturing stabilized polyacetal resin POLYPLASTICS CO (JP) 2012-10-31 EP disclosed
US-20080271381-A1 Method for manufacturing stabilized polyacetal resin, stabilized polyacetal resin, stabilized polyacetal resin composition, and molded article of stabilized polyacetal resin POLYPLASTICS CO., LTD (JP) 2008-11-06 US disclosed
EP-1867667-A1 Method for manufacturing stabilized polyacetal resin, stabilized polyacetal resin, stabilized polyacetal resin composition, and molded article of stabilized polyacetal resin Polyplastics Co., Ltd. (JP) 2007-12-19 EP 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 (2 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-20210388016-A1 GLUCOPYRANOSE DERIVATIVES USEFUL AS SGLT2 INHIBITORS SLC5A2, SLC5A1, UGGT1 KDM4E 3103/4885TSHR 4290/4885LMNA 3702/4885
US-20210388015-A1 GLUCOPYRANOSE DERIVATIVES USEFUL AS SGLT2 INHIBITORS SLC5A2, SLC5A1, UGGT1 KDM4E 3103/4885TSHR 4290/4885LMNA 3702/4885

“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.