SCHEMBL23326686

SCHEMBL23326686

[CH]1CCCCN(C2CCCNCCC2)CC1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.44
L3MBTL3 Q96JM7 12/20 0.38
L3MBTL1 Q9Y468 11/20 0.38
MBTD1 Q05BQ5 6/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HRH3 Q9Y5N1 2/20 0.33
TP53BP1 Q12888 1/20 0.32
L3MBTL4 Q8NA19 1/20 0.32
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL2003194 0.86 L3MBTL3 (0.42) HTR6L3MBTL3L3MBTL1MBTD1KMT2A
SCHEMBL2004013 0.86 L3MBTL3 (0.42) HTR6L3MBTL3L3MBTL1MBTD1KMT2A
SCHEMBL2003309 0.84 L3MBTL3 (0.41) HTR6L3MBTL3L3MBTL1MBTD1KMT2A
SCHEMBL2006298 0.84 L3MBTL3 (0.41) HTR6L3MBTL3L3MBTL1MBTD1KMT2A
SCHEMBL2006890 0.84 L3MBTL3 (0.43) HTR6L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL1892359 0.81 HTR6 (0.57) HTR6KMT2ASMN1; SMN2
SCHEMBL2572491 0.80 KMT2A (0.39) HTR6L3MBTL3L3MBTL1HPGDKMT2A
SCHEMBL2009840 0.80 L3MBTL3 (0.39) HTR6L3MBTL3L3MBTL1MBTD1KMT2A
SCHEMBL2007966 0.80 L3MBTL3 (0.39) HTR6L3MBTL3L3MBTL1MBTD1TP53BP1
SCHEMBL12730892 0.80 HTR6 (0.54) HTR6L3MBTL3L3MBTL1MBTD1HPGD

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-20210137939-A1 INHIBITORS OF THE RAS ONCOPROTEIN, METHODS OF MAKING AND METHODS OF USE THEREOF UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. 2021-05-13 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-20210137939-A1 INHIBITORS OF THE RAS ONCOPROTEIN, METHODS OF MAKING AND METHODS OF USE THEREOF KRAS, NRAS, HRAS HTR6 4854/4885L3MBTL3 1301/4885L3MBTL1 598/4885

“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.