SCHEMBL19795333

SCHEMBL19795333

Cc1cn(C)c2ncc(Nc3n[nH]c4ncccc34)cc12

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 19/20 0.40
KDM4E B2RXH2 1/20 0.36
KDM6B O15054 1/20 0.36
KDM5A P29375 1/20 0.36
KDM4C Q9H3R0 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
SCHEMBL19795334 0.85 FADS1 (0.46) GRM4
SCHEMBL19795325 0.84 GRM4 (0.58) GRM4
SCHEMBL19795210 0.82 GRM4 (0.51) GRM4KDM5AKDM4C
SCHEMBL19795184 0.77 GRM4 (0.51) GRM4
SCHEMBL19794809 0.74 GRM4 (0.48) GRM4
SCHEMBL19795050 0.73 GRM4 (0.49) GRM4
SCHEMBL19798288 0.73 GRM4 (0.49) GRM4
SCHEMBL17935869 0.70 GRM4 (0.72) GRM4
SCHEMBL823082 0.69 DYRK1A (0.50) KDM4EKDM6BKDM5AKDM4C
SCHEMBL19795318 0.68 GRM4 (0.57) GRM4

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-20180022746-A1 INDAZOLE AND AZAINDAZOLE SUBSTITUTED COMPOUNDS AS MGLUR4 ALLOSTERIC POTENTIATORS, COMPOSITIONS, AND METHODS OF TREATING NEUROLOGICAL DYSFUNCTION VANDERBILT UNIVERSITY 2018-01-25 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-20180022746-A1 INDAZOLE AND AZAINDAZOLE SUBSTITUTED COMPOUNDS AS MGLUR4 ALLOSTERIC POTENTIATORS, COMPOSITIONS, AND METHODS OF TREATING NEUROLOGICAL DYSFUNCTION GRIK4, GRM4, GRIA4 GRM4 2/4885KDM4E 990/4885KDM6B 3098/4885

“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.