SCHEMBL22960801

SCHEMBL22960801

CC(C)(C)OC(=O)n1c2ccncc2c2ccc(-c3ccc(Br)nc3)nc21

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.39
▸ GABRG2 P18507 2/20 0.35
▸ GABRB3 P28472 2/20 0.35
▸ GABRA5 P31644 2/20 0.35
▸ GABRA1 P14867 1/20 0.34
▸ GABRA2 P47869 1/20 0.34
▸ GABRA6 Q16445 1/20 0.34
▸ TTK P33981 1/20 0.33
▸ CYP19A1 P11511 1/20 0.33
▸ BTK Q06187 1/20 0.33
▸ GPR119 Q8TDV5 3/20 0.33
▸ NR1H2 P55055 3/20 0.33
▸ USP30 Q70CQ3 1/20 0.33
▸ SLC22A12 Q96S37 1/20 0.32

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
SCHEMBL16637427 0.90 MAPT (0.41) MAPTGABRG2GABRB3GABRA5GABRA1
SCHEMBL19805011 0.88 GABRG2 (0.37) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL21308367 0.85 MAPT (0.36) MAPTGABRG2GABRB3GABRA5GABRA1
SCHEMBL21310437 0.83 AAK1 (0.39) MAPTGABRG2GABRB3GABRA5GABRA1
SCHEMBL16637537 0.79 GABRG2 (0.37) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL19806740 0.77 DDB1 (0.42) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL16597821 0.74 GABRG2 (0.42) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL18012185 0.73 GABRG2 (0.41) MAPTGABRG2GABRB3GABRA5GABRA1
SCHEMBL29773883 0.71 CHRM2 (0.49) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL16610350 0.71 GPR119 (0.46) MAPTGABRG2GABRB3GABRA5GABRA1

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-20210038747-A1 NOVEL METHOD OF PREPARING AN IMAGING COMPOUND LIFE MOLECULAR IMAGING LIMITED (GB) 2021-02-11 — — 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-20210038747-A1 NOVEL METHOD OF PREPARING AN IMAGING COMPOUND MAPT, PSEN2, PSEN1 MAPT 1/4885GABRG2 2842/4885GABRB3 2359/4885

“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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