SCHEMBL682816

SCHEMBL682816

Cc1cccc(N2CCN(Cn3cnc4c3c(=O)n(C)c(=O)n4C)CC2)c1C

nearest known ligand 0.74

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.55
HTR7 P34969 1/20 0.53
HTR6 P50406 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
CYP1A2 P05177 1/20 0.51
MAPK1 P28482 1/20 0.49
TP53 P04637 2/20 0.49
RXFP1 Q9HBX9 2/20 0.48
ADORA2B P29275 6/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 1/20 0.47
RAB9A P51151 1/20 0.47
MAPT P10636 1/20 0.46
LMNA P02545 1/20 0.46
CASP1 P29466 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
SCHEMBL11150077 0.92 HTR7 (0.58) TSHRHTR7HTR6L3MBTL1CYP1A2
SCHEMBL682810 0.92 HTR7 (0.58) TSHRHTR7HTR6L3MBTL1CYP1A2
SCHEMBL11150494 0.89 HTR7 (0.69) TSHRHTR7HTR6L3MBTL1CYP1A2
SCHEMBL682814 0.88 HTR7 (0.56) TSHRHTR7HTR6L3MBTL1CYP1A2
SCHEMBL684356 0.85 HTR7 (0.58) TSHRHTR7HTR6L3MBTL1MAPK1
SCHEMBL684024 0.83 HTR7 (0.51) TSHRHTR7HTR6L3MBTL1MAPK1
SCHEMBL683660 0.83 HTR7 (0.51) TSHRHTR7HTR6L3MBTL1MAPK1
SCHEMBL2626922 0.83 HTR7 (0.63) TSHRHTR7HTR6L3MBTL1CYP1A2
SCHEMBL682820 0.82 L3MBTL1 (0.73) TSHRHTR7HTR6L3MBTL1
SCHEMBL683696 0.82 HTR2A (0.48) TSHRCYP1A2MAPK1RXFP1ADORA2B

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 TSHR 1873/4885HTR7 1398/4885HTR6 683/4885

“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.