SCHEMBL18292374

SCHEMBL18292374

CC(C)c1ccc(-n2cc(-c3ccnc4ccccc34)cn2)cc1

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 20/20 0.74
▸ KCNH2 Q12809 2/20 0.74
▸ HTR2B P41595 1/20 0.74
▸ MTNR1A P48039 1/20 0.74

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
SCHEMBL15942032 0.86 GRM4 (1.00) GRM4KCNH2HTR2BMTNR1A
SCHEMBL7859091 0.84 GRM4 (1.00) GRM4KCNH2HTR2BMTNR1A
SCHEMBL2710540 0.80 GRM4 (0.77) GRM4KCNH2HTR2BMTNR1A
SCHEMBL28199101 0.79 GRM4 (0.85) GRM4KCNH2HTR2BMTNR1A
SCHEMBL17125376 0.78 GRM4 (0.67) GRM4KCNH2HTR2BMTNR1A
SCHEMBL355762 0.74 GRM4 (0.65) GRM4KCNH2HTR2BMTNR1A
SCHEMBL31428975 0.74 GRM4 (0.65) GRM4KCNH2HTR2BMTNR1A
SCHEMBL20061111 0.70 CA12 (0.55) —
SCHEMBL5216629 0.69 PDE10A (0.44) GRM4
SCHEMBL5216817 0.69 GRM4 (0.87) GRM4KCNH2HTR2BMTNR1A

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-20160354375-A1 CASEIN KINASE 1delta (CK 1delta) INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES SUCH AS TAUOPATHIES ELECTROPHORETICS LIMITED (GB) 2016-12-08 — — 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-20160354375-A1 CASEIN KINASE 1delta (CK 1delta) INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES SUCH AS TAUOPATHIES CSNK1G1, CSNK1A1, CSNK1D GRM4 2827/4885KCNH2 2523/4885HTR2B 3412/4885

“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.

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