SCHEMBL13898780

SCHEMBL13898780

CC(CCCCN1CCN(c2ccncc2)C1=O)Oc1ccc(-c2nn[nH]n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LARS1 Q9P2J5 1/20 0.49
GRM2 Q14416 3/20 0.42
DRD2 P14416 1/20 0.40
PDE3A Q14432 4/20 0.38
XDH P47989 1/20 0.38
CYP19A1 P11511 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KCNH2 Q12809 2/20 0.37
TBXAS1 P24557 1/20 0.37
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL13898737 0.85 LARS1 (0.51) LARS1DRD2PDE3AXDHCYP19A1
SCHEMBL13898794 0.84 LARS1 (0.69) LARS1DRD2PDE3ACYP19A1CYP2C9
SCHEMBL13899041 0.83 LARS1 (0.49) LARS1DRD2KCNH2
SCHEMBL3913145 0.83 LARS1 (0.70) LARS1DRD2KCNH2
SCHEMBL13899052 0.83 LARS1 (0.56) LARS1DRD2KCNH2
SCHEMBL13899045 0.82 LARS1 (0.52) LARS1DRD2PDE3AXDHCYP19A1
SCHEMBL13899042 0.81 LARS1 (0.49) LARS1GRM2PDE3AXDHCYP19A1
SCHEMBL13898776 0.81 LARS1 (0.49) LARS1DRD2CYP2C9CYP2C19KCNH2
SCHEMBL13899037 0.80 LARS1 (0.47) LARS1DRD2CYP2C9KCNH2TP53
SCHEMBL13899020 0.79 LARS1 (0.46) LARS1

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-7501445-B2 Imidazolidinone compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-03-10 US disclosed
US-20070049623-A1 Imidazolidinone compounds NATIONAL HEALTH RESEARCH INSTITUTES, A TAIWAN CORPORATION 2007-03-01 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-20070049623-A1 Imidazolidinone compounds PKN2, PKN1, EIF2AK2 LARS1 4511/4885GRM2 1388/4885DRD2 4100/4885

“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.