SCHEMBL3242406

SCHEMBL3242406

[CH2]c1ccc(CNCCc2ccccc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.74
MAPT P10636 1/20 0.74
BCHE P06276 4/20 0.60
MEN1 O00255 4/20 0.59
KMT2A Q03164 4/20 0.59
TDP1 Q9NUW8 1/20 0.59
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
CA12 O43570 1/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA4 P22748 1/20 0.58
CA9 Q16790 1/20 0.58
SIGMAR1 Q99720 4/20 0.58
ATM Q13315 1/20 0.54
MAOA P21397 1/20 0.53
LTA4H P09960 1/20 0.53
EPHX2 P34913 1/20 0.53
CHRM2 P08172 1/20 0.52

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
SCHEMBL11881258 0.90 GAA (0.91) GAAMAPTBCHEMEN1KMT2A
SCHEMBL3272134 0.90 GAA (0.91) GAAMAPTBCHEMEN1KMT2A
SCHEMBL27228 0.88 GAA (0.95) GAAMAPTBCHEMEN1KMT2A
Ammonia Solution, Strong SCHEMBL23581968 0.86 GAA (0.91) GAAMAPTBCHEMEN1KMT2A
SCHEMBL25432637 0.86 GAA (0.91) GAAMAPTBCHEMEN1KMT2A
Hydrochloric Acid SCHEMBL1983401 0.86 GAA (1.00) GAAMAPTBCHEMEN1KMT2A
SCHEMBL10060315 0.84 GAA (0.80) GAAMAPTBCHEMEN1KMT2A
SCHEMBL23859923 0.84 MEN1 (0.77) GAAMAPTMEN1KMT2ATDP1
SCHEMBL3240146 0.83 L3MBTL1 (0.69) GAAMAPTKDM4EALDH1A1CA12
SCHEMBL10133040 0.82 GAA (0.77) GAAMAPTBCHEMEN1KMT2A

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-20100144733-A1 Compounds, compositions and methods comprising heteroaromatic derivatives INSTITUTE FOR ONEWORLD HEALTH 2010-06-10 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-20100144733-A1 Compounds, compositions and methods comprising heteroaromatic derivatives CFTR, PKD1, PKD2 GAA 714/4885MAPT 4877/4885BCHE 2569/4885

“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.