SCHEMBL684005

SCHEMBL684005

CCOc1cccc(N2CCN(Cn3cnc4c3c(=O)n(C)c(=O)n4C)CC2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.58
HTR6 P50406 1/20 0.58
MAPK1 P28482 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.53
TP53 P04637 1/20 0.52
RXFP1 Q9HBX9 1/20 0.52
SMN1; SMN2 Q16637 5/20 0.48
ALDH1A1 P00352 4/20 0.48
MAPT P10636 2/20 0.48
HTT P42858 3/20 0.47
LMNA P02545 2/20 0.47
GAA P10253 2/20 0.47
TSHR P16473 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
RAB9A P51151 1/20 0.47
MAOB P27338 2/20 0.46
MAOA P21397 1/20 0.46
GLA P06280 2/20 0.46
UBE2N P61088 1/20 0.46
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL683994 0.91 RXFP1 (0.63) HTR7HTR6MAPK1L3MBTL1TP53
SCHEMBL11151494 0.90 HTR7 (0.74) HTR7HTR6MAPK1L3MBTL1TP53
SCHEMBL684041 0.89 HTR7 (0.58) HTR7HTR6MAPK1L3MBTL1RXFP1
SCHEMBL683995 0.87 MAPK1 (0.72) HTR7HTR6MAPK1L3MBTL1TP53
SCHEMBL683656 0.87 HTR7 (0.61) HTR7HTR6MAPK1L3MBTL1TP53
SCHEMBL683655 0.85 HTR7 (0.77) HTR7HTR6MAPK1L3MBTL1RXFP1
SCHEMBL683612 0.83 HTR7 (0.57) HTR7HTR6MAPK1L3MBTL1TP53
SCHEMBL684377 0.83 MAPK1 (0.47) HTR7HTR6MAPK1SMN1; SMN2ALDH1A1
SCHEMBL683998 0.82 HTR7 (0.57) HTR7HTR6MAPK1L3MBTL1RXFP1
SCHEMBL683604 0.82 RXFP1 (0.62) HTR7HTR6MAPK1L3MBTL1TP53

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 HTR7 1398/4885HTR6 683/4885MAPK1 470/4885

“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.