SCHEMBL684332

SCHEMBL684332

Cn1c(=O)c2c(ncn2CCN2CCC(C(=O)c3ccc(Cl)cc3)CC2)n(C)c1=O

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.55
LMNA P02545 3/20 0.55
CHRM2 P08172 1/20 0.50
HTR1A P08908 1/20 0.50
CHRM1 P11229 1/20 0.50
DRD2 P14416 1/20 0.50
ADRA1D P25100 1/20 0.50
ADRA1A P35348 1/20 0.50
ADRA1B P35368 1/20 0.50
ADORA2B P29275 7/20 0.49
MAPT P10636 1/20 0.49
HTR2A P28223 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
POLB P06746 1/20 0.48
RXFP1 Q9HBX9 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL683617 0.91 CHRM2 (0.51) MAPK1LMNACHRM2HTR1ACHRM1
Flufylline SCHEMBL684324 0.90 HTR2A (0.60) LMNACHRM2HTR1ACHRM1DRD2
SCHEMBL683965 0.88 LMNA (0.58) MAPK1LMNACHRM2HTR1ACHRM1
SCHEMBL684325 0.85 CHRM2 (0.49) MAPK1LMNACHRM2HTR1ACHRM1
Fluprofylline SCHEMBL683614 0.85 HTR1A (0.64) MAPK1CHRM2HTR1ACHRM1DRD2
Perbufylline SCHEMBL682795 0.85 HTR1A (0.61) MAPK1CHRM2HTR1ACHRM1DRD2
SCHEMBL10721910 0.84 HTR1A (0.60) MAPK1CHRM2HTR1ACHRM1DRD2
SCHEMBL683633 0.81 CHRM2 (0.51) MAPK1LMNACHRM2HTR1ACHRM1
SCHEMBL683632 0.81 CHRM2 (0.51) MAPK1LMNACHRM2HTR1ACHRM1
SCHEMBL682797 0.81 ALDH1A1 (0.60) MAPK1LMNACHRM2HTR1ACHRM1

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 2 patents. 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
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 MAPK1 470/4885LMNA 2155/4885CHRM2 671/4885

“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.