SCHEMBL684342

SCHEMBL684342

Cn1c(=O)c2c(ncn2CCCN2CCCN(Cc3cccc(Cl)c3)CC2)n(C)c1=O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.70
HTT P42858 2/20 0.70
UBE2N P61088 2/20 0.70
GLA P06280 1/20 0.70
L3MBTL1 Q9Y468 1/20 0.70
TSHR P16473 2/20 0.58
TP53 P04637 2/20 0.58
ALDH1A1 P00352 2/20 0.58
ALOX15 P16050 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
HTR7 P34969 1/20 0.55
HTR6 P50406 1/20 0.55
ADORA3 P0DMS8 1/20 0.54
MAOB P27338 1/20 0.54
ADORA2A P29274 1/20 0.54
ADORA2B P29275 3/20 0.53
RXFP1 Q9HBX9 2/20 0.53
HTR1A P08908 4/20 0.53
CHRM1 P11229 2/20 0.53
DRD2 P14416 2/20 0.53

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
SCHEMBL683634 0.90 HTR7 (0.67) SMN1; SMN2HTTUBE2NGLAL3MBTL1
SCHEMBL684347 0.89 LMNA (0.67) SMN1; SMN2HTTUBE2NGLAL3MBTL1
SCHEMBL684348 0.88 SMN1; SMN2 (0.69) SMN1; SMN2HTTUBE2NGLAL3MBTL1
SCHEMBL10896398 0.88 LMNA (0.67) SMN1; SMN2HTTUBE2NGLAL3MBTL1
Hydrochloric Acid SCHEMBL10896818 0.87 SMN1; SMN2 (0.68) SMN1; SMN2HTTUBE2NGLAL3MBTL1
Hydrochloric Acid SCHEMBL10899529 0.87 SMN1; SMN2 (0.68) SMN1; SMN2HTTUBE2NGLAL3MBTL1
SCHEMBL683981 0.85 TP53 (0.54) SMN1; SMN2HTTUBE2NGLAL3MBTL1
SCHEMBL684013 0.85 HTR1A (0.69) SMN1; SMN2HTTUBE2NTSHRALDH1A1
SCHEMBL10896463 0.83 RXFP1 (0.60) SMN1; SMN2HTTUBE2NTSHRTP53
SCHEMBL684338 0.83 HTR7 (0.60) SMN1; SMN2HTTUBE2NL3MBTL1TSHR

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-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN BRAINCELLS INC. (US) 2011-11-03 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-20110269717-A1 NEUROGENESIS BY MODULATING ANGIOTENSIN NGF, DCX, BDNF SMN1; SMN2 907/4885HTT 751/4885UBE2N 2362/4885

“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.