SCHEMBL1129612

SCHEMBL1129612

CCCCN(CCCC)C(=O)CC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA9 Q16790 2/20 0.50
MMP1 P03956 1/20 0.47
MMP2 P08253 1/20 0.47
MMP3 P08254 1/20 0.47
MMP8 P22894 1/20 0.47
KDM5A P29375 9/20 0.46
KDM4C Q9H3R0 9/20 0.46
PHF8 Q9UPP1 3/20 0.43
KDM4A O75164 2/20 0.43
SIGMAR1 Q99720 1/20 0.42
AKR1B1 P15121 1/20 0.41
KDM5C P41229 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
ALDH1A1 P00352 1/20 0.40
ALDH2 P05091 1/20 0.40

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
SCHEMBL1128973 0.91 KDM5A (0.49) CA12CA1CA9KDM5AKDM4C
SCHEMBL283713 0.88 CA12 (0.56) CA12CA1CA9MMP1MMP2
SCHEMBL15512222 0.83 HAO1 (0.47) CA12CA1CA9MMP1MMP2
SCHEMBL2417403 0.82 CA12 (0.50) CA12CA1CA9MMP1MMP2
SCHEMBL3625206 0.81 CA12 (0.48) CA12CA1CA9MMP1MMP2
SCHEMBL15512059 0.81 KMT2A (0.50) KDM5AKDM4CPHF8AKR1B1ALDH1A1
SCHEMBL11192785 0.80 KDM4C (0.49) KDM5AKDM4CPHF8KDM4AAKR1B1
SCHEMBL12323564 0.80 CA12 (0.48) CA12CA1CA9MMP1MMP2
SCHEMBL15016405 0.80 CA12 (0.48) CA12CA1CA9MMP1MMP2
SCHEMBL10339549 0.80 ALDH1A1 (0.52) CA12CA1CA9MMP1MMP2

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-11873468-B2 Polymers for the treatment of surfaces HENKEL AG & CO. KGAA (DE) 2024-01-16 US disclosed
US-20110070657-A1 DETECTING IONS AND MEASURING ION CONCENTRATIONS THE GENERAL HOSPITAL CORPORATION (US) 2011-03-24 US disclosed
US-20110070657-A1 DETECTING IONS AND MEASURING ION CONCENTRATIONS THE GENERAL HOSPITAL CORPORATION (US) 2011-03-24 US disclosed
EP-1996602-B1 NOVEL LACTOSAMINE DERIVATIVES GLYCOM APS (DK) 2011-02-16 EP disclosed
WO-2009026251-A1 DETECTING IONS AND MEASURING ION CONCENTRATIONS THE GENERAL HOSPITAL CORPORATION (US) 2009-02-26 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 (1 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-20110070657-A1 DETECTING IONS AND MEASURING ION CONCENTRATIONS CA2, SLC30A5, CA3 CA12 68/4885CA1 36/4885CA9 188/4885

“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.