SCHEMBL14749231

SCHEMBL14749231

Cc1ccc(Cc2cnc(-c3nc4c(N5CCN(C)C5=O)cc(N(C)C)cn4c(=O)c3O)s2)cc1

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GAA P10253 1/20 0.31
SIRT2 Q8IXJ6 1/20 0.30
PAK1 Q13153 1/20 0.30
CCR6 P51684 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
SCHEMBL1222312 0.93 PARP1 (0.32) NPC1RAB9ASMN1; SMN2GAACCR6
SCHEMBL13512877 0.83
SCHEMBL12894141 0.82 PARP1 (0.30)
SCHEMBL1222203 0.81 CYP1A2 (0.36) SMN1; SMN2
SCHEMBL1222045 0.81 ALDH1A1 (0.34)
SCHEMBL10325890 0.80 GAA (0.32) SMN1; SMN2GAAPAK1CCR6
SCHEMBL13512875 0.80 LMNA (0.33)
SCHEMBL13512876 0.79 PARP1 (0.36) PAK1
SCHEMBL1221366 0.78 PIK3CD (0.37) PAK1
SCHEMBL15334697 0.78 PARP1 (0.35) PAK1

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-20130059865-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LIMITED (AU) 2013-03-07 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-20130059865-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES ZC3HAV1, ACE, EIF2AK2 NPC1 52/4885RAB9A 1032/4885SMN1; SMN2 903/4885

“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.