SCHEMBL682832

SCHEMBL682832

Cc1cccc(N2CCN(Cn3c(=O)c4c(ncn4C)n(C)c3=O)CC2C)c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.49
MAPK1 P28482 2/20 0.45
HTR2A P28223 1/20 0.44
GAA P10253 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
THRB P10828 1/20 0.42
ADORA2B P29275 4/20 0.42
TP53 P04637 1/20 0.41
GLA P06280 1/20 0.41
BLM P54132 1/20 0.41

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
SCHEMBL683669 0.91 MAPK1 (0.45) MAPTMAPK1HTR2AADORA2BGLA
SCHEMBL683707 0.89 ADORA2B (0.45) MAPTMAPK1HTR2AMEN1KMT2A
SCHEMBL684026 0.85 MAPK1 (0.49) MAPTMAPK1HTR2AMEN1KMT2A
SCHEMBL684045 0.84 MAPT (0.50) MAPTMAPK1MEN1KMT2AADORA2B
Hydrochloric Acid SCHEMBL11153642 0.78 HTR7 (0.61) MAPTMAPK1ADORA2B
SCHEMBL683664 0.75 MAPK1 (0.56) MAPTMAPK1GAAADORA2BGLA
SCHEMBL684023 0.75 HTR2A (0.58) MAPK1HTR2AKMT2AADORA2BGLA
SCHEMBL683652 0.75 MAPK1 (0.55) MAPTMAPK1HTR2AGAATP53
SCHEMBL682830 0.74 ADORA2B (0.50) HTR2AADORA2BGLABLM
SCHEMBL682822 0.74 RXFP1 (0.57) MAPTMAPK1ADORA2BTP53GLA

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 MAPT 1368/4885MAPK1 470/4885HTR2A 1201/4885

“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.