SCHEMBL13899042

SCHEMBL13899042

CC(CCCOc1ccc(-c2nn[nH]n2)cc1)CN1CCN(c2ccncc2)C1=O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LARS1 Q9P2J5 1/20 0.49
CYP19A1 P11511 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
PDE3A Q14432 9/20 0.44
TBXAS1 P24557 1/20 0.43
GRM2 Q14416 4/20 0.41
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41
XDH P47989 1/20 0.40

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
SCHEMBL13899045 0.88 LARS1 (0.52) LARS1CYP19A1CYP2C9CYP2C19PDE3A
SCHEMBL13898737 0.87 LARS1 (0.51) LARS1CYP19A1CYP2C9CYP2C19PDE3A
SCHEMBL13898794 0.84 LARS1 (0.69) LARS1CYP19A1CYP2C9CYP2C19PDE3A
SCHEMBL13898966 0.83 LARS1 (0.49) LARS1ALDH1A1TP53
SCHEMBL13899059 0.83 LARS1 (0.56) LARS1
SCHEMBL3914826 0.83 LARS1 (0.70) LARS1
SCHEMBL13898735 0.83 CYP19A1 (0.47) LARS1CYP19A1CYP2C9CYP2C19PDE3A
SCHEMBL13898774 0.81 LARS1 (0.49) LARS1CYP2C9CYP2C19ALDH1A1TP53
SCHEMBL13898780 0.81 LARS1 (0.49) LARS1CYP19A1CYP2C9CYP2C19PDE3A
SCHEMBL13898727 0.80 LARS1 (0.47) LARS1TP53

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 4511/4885CYP19A1 3424/4885CYP2C9 1730/4885

“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.