SCHEMBL13637639

SCHEMBL13637639

Cc1cccc(CN2CCN(c3cccc(CN)c3)CC2)c1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.65
MAPT P10636 2/20 0.65
KDM4E B2RXH2 2/20 0.65
PRMT6 Q96LA8 1/20 0.55
DRD4 P21917 3/20 0.54
DRD2 P14416 3/20 0.54
KCNH2 Q12809 2/20 0.54
NCF1 P14598 1/20 0.51
DRD3 P35462 1/20 0.51
TSHR P16473 1/20 0.51
HTR7 P34969 1/20 0.51
HTT P42858 1/20 0.50

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
SCHEMBL6858091 0.85 ALDH1A1 (0.76) ALDH1A1MAPTKDM4EDRD4DRD2
SCHEMBL6263381 0.85 DRD4 (0.70) ALDH1A1MAPTKDM4EPRMT6DRD4
SCHEMBL27662780 0.82 AGXT (0.56) ALDH1A1MAPTPRMT6DRD4DRD2
SCHEMBL2376462 0.81 CHRNA7 (0.59) MAPTKDM4EPRMT6DRD4DRD2
SCHEMBL6865778 0.80 KDM4E (0.67) ALDH1A1MAPTKDM4ETSHRHTR7
SCHEMBL15938014 0.80 HTR7 (0.67) ALDH1A1MAPTKDM4EDRD4DRD2
SCHEMBL4453962 0.78 LOXL2 (0.64) ALDH1A1MAPTTSHRHTR7
SCHEMBL15829997 0.78 ALDH1A1 (0.59) ALDH1A1MAPTKDM4EPRMT6DRD4
SCHEMBL109344 0.77 AGXT (0.69) ALDH1A1MAPTKDM4EPRMT6KCNH2
SCHEMBL6031187 0.77 ALDH1A1 (0.77) ALDH1A1MAPTKDM4EDRD4DRD2

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-20090275583-A1 ANTIVIRAL COMPOUNDS AND USE THEREOF MYRIAD GENETICS, INCORPORATED (US) 2009-11-05 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-20090275583-A1 ANTIVIRAL COMPOUNDS AND USE THEREOF MAVS, ZC3HAV1, EIF2AK2 ALDH1A1 2676/4885MAPT 2949/4885KDM4E 2622/4885

“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.