SCHEMBL25859202

SCHEMBL25859202

N[C@H]1CN(c2ccc(C(F)(F)F)cc2)C(=O)c2c(I)cnn21

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 18/20 0.53
KCNH2 Q12809 1/20 0.46
HIF1A Q16665 1/20 0.35

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
SCHEMBL18457880 0.86 GRM2 (0.71) GRM2KCNH2
SCHEMBL25859256 0.86 GRM2 (0.53) GRM2KCNH2HIF1A
SCHEMBL16397720 0.86 GRM2 (0.53) GRM2KCNH2HIF1A
SCHEMBL17478016 0.86 GRM2 (0.71) GRM2KCNH2
SCHEMBL17490644 0.86 GRM2 (0.71) GRM2KCNH2
SCHEMBL22622668 0.84 GRM2 (0.47) GRM2
SCHEMBL22622618 0.83 GRM2 (0.53) GRM2KCNH2
SCHEMBL22622584 0.82 GRM2 (0.55) GRM2KCNH2
SCHEMBL17485526 0.80 GRM2 (0.52) GRM2KCNH2
SCHEMBL22949599 0.78 GRM2 (0.48) GRM2

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-20230210850-A1 PROCESS FOR PREPARING SUBSTITUTED PYRAZOLO[1,5-a]PYRAZINES Sumitomo Pharma Co., Ltd. (JP) 2023-07-06 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-20230210850-A1 PROCESS FOR PREPARING SUBSTITUTED PYRAZOLO[1,5-a]PYRAZINES CYP3A5, CYP2F1, CYP4Z1 GRM2 3682/4885KCNH2 275/4885HIF1A 2903/4885

“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.