SCHEMBL14320256

SCHEMBL14320256

CCN(CC)c1ccc(/C=C/C2=C/C(=C/C=O)CC(C)(C)C2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.44
ALDH3A1 P30838 1/20 0.44
ALDH1A3 P47895 1/20 0.44
MEN1 O00255 10/20 0.40
KMT2A Q03164 10/20 0.40
MAPT P10636 7/20 0.40
LMNA P02545 4/20 0.40
MAPK1 P28482 3/20 0.36
RECQL P46063 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
POLB P06746 2/20 0.36
TLR9 Q9NR96 2/20 0.36
USP2 O75604 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HPGD P15428 2/20 0.36
CRHBP P24387 2/20 0.36
CRHR2 Q13324 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2C19 P33261 2/20 0.36

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
SCHEMBL14320257 1.00 ALDH1A1 (0.44) ALDH1A1ALDH3A1ALDH1A3MEN1KMT2A
SCHEMBL12482005 0.87 ALDH1A1 (0.37) ALDH1A1ALDH3A1ALDH1A3MEN1KMT2A
SCHEMBL14329685 0.86 ALDH1A1 (0.36) ALDH1A1ALDH3A1ALDH1A3MEN1KMT2A
SCHEMBL14328155 0.84 ALDH1A1 (0.35) ALDH1A1ALDH3A1ALDH1A3MEN1KMT2A
SCHEMBL14328142 0.83 ALDH1A1 (0.38) ALDH1A1ALDH3A1ALDH1A3MEN1KMT2A
SCHEMBL14328168 0.83 ALDH1A3 (0.34) ALDH1A1ALDH3A1ALDH1A3MEN1KMT2A
SCHEMBL14329620 0.80 APP (0.37) ALDH1A1ALDH3A1ALDH1A3MEN1KMT2A
SCHEMBL5858618 0.79
SCHEMBL14328150 0.77 CHRM2 (0.31) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8977050 0.74 MEN1 (0.32) ALDH1A1MEN1KMT2A

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-20120329865-A1 MOLECULES RELATED hERG ION CHANNELS AND THE USE THEREOF CORNING INCORPORATED 2012-12-27 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-20120329865-A1 MOLECULES RELATED hERG ION CHANNELS AND THE USE THEREOF KCNH2, KCNJ2, KCNH3 ALDH1A1 1574/4885ALDH3A1 1577/4885ALDH1A3 741/4885

“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.