SCHEMBL19601301

SCHEMBL19601301

CCCN(C)CC(O)CC

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 2/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GGPS1 O95749 3/20 0.34
TSHR P16473 1/20 0.30

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
SCHEMBL19450514 0.90 KDM4E (0.41) ABCB1KDM4EL3MBTL1GGPS1
SCHEMBL79622 0.84 TSHR (0.37) KDM4EL3MBTL1TSHR
SCHEMBL10283826 0.83 KCNA5 (0.38) ABCB1KDM4EL3MBTL1GGPS1
SCHEMBL20356793 0.83 CA12 (0.46) KDM4EL3MBTL1
SCHEMBL17383350 0.83 KDM4E (0.34) KDM4EL3MBTL1
SCHEMBL7528385 0.83 KDM4E (0.50) KDM4EL3MBTL1
SCHEMBL7147102 0.81 CA12 (0.50) KDM4EL3MBTL1
SCHEMBL3930915 0.81 CA12 (0.50) KDM4EL3MBTL1
SCHEMBL3921745 0.81 CA12 (0.50) KDM4EL3MBTL1
SCHEMBL15836119 0.79 PIK3CD (0.43) ABCB1KDM4EL3MBTL1GGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170326149-A1 HYDROXYL PURINE COMPOUNDS AND APPLICATIONS THEREOF GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-11-16 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 (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-20170326149-A1 HYDROXYL PURINE COMPOUNDS AND APPLICATIONS THEREOF PNP, PDE2A, PDE7A ABCB1 379/4885KDM4E 4302/4885L3MBTL1 4846/4885

“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.