SCHEMBL13202064

SCHEMBL13202064

CN1C(C)(C)CC(OCC(O)CNCCNCCN)CC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 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
SCHEMBL13202053 0.93 MEN1 (0.33) MEN1HTTKMT2A
SCHEMBL7211170 0.90 MEN1 (0.30) MEN1HTTKMT2A
SCHEMBL13202049 0.82 MEN1 (0.33) MEN1HTTKMT2A
SCHEMBL5405789 0.75 KDM4E (0.32) MEN1HTTKMT2A
SCHEMBL5405785 0.74 TOP2A (0.31) MEN1HTTKMT2A
SCHEMBL21669376 0.74 MEN1 (0.33) MEN1HTTKMT2A
SCHEMBL10299821 0.73 MEN1 (0.33) MEN1HTTKMT2A
SCHEMBL11216083 0.72 LMNA (0.33) MEN1KMT2A
SCHEMBL19914911 0.71 KDM4E (0.33) KMT2A
SCHEMBL13328965 0.71 TSHR (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7776182-B2 Chlorohydrin and cationic compounds having high affinity for pulp or paper CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-08-17 US disclosed
US-20080060775-A1 Chlorohydrin and cationic compounds having high affinity for pulp or paper CUNKLE GLEN T 2008-03-13 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-20080060775-A1 Chlorohydrin and cationic compounds having high affinity for pulp or paper NISCH, HNMT, LCT MEN1 4149/4885HTT 372/4885KMT2A 802/4885

“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.