SCHEMBL4916255

SCHEMBL4916255

COc1cccc(-c2c(F)ccc3c(N)c4c(nc23)CN(C2=CC=C2)C4=O)c1F

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GABRG2 P18507 5/20 0.33
▸ GABRB3 P28472 5/20 0.33
▸ GABRA2 P47869 5/20 0.33
▸ GABRA1 P14867 1/20 0.33
▸ GABRA5 P31644 1/20 0.33
▸ GABRA3 P34903 1/20 0.33
▸ GNRHR P30968 12/20 0.33
▸ RPS6KA2 Q15349 1/20 0.32
▸ UGCG Q16739 1/20 0.32
▸ BACE1 P56817 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31

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
SCHEMBL2657622 0.93 UGCG (0.35) GABRG2GABRB3GABRA2GABRA1GABRA5
SCHEMBL2658032 0.91 UGCG (0.33) GABRG2GABRB3GABRA2GABRA1GABRA5
SCHEMBL2658971 0.88 GABRG2 (0.39) GABRG2GABRB3GABRA2UGCGBACE1
SCHEMBL2660626 0.88 GABRG2 (0.37) GABRG2GABRB3GABRA2UGCG
SCHEMBL2657233 0.87 GABRA1 (0.43) GABRG2GABRB3GABRA2GABRA1GABRA5
SCHEMBL2659113 0.85 GABRG2 (0.47) GABRG2GABRB3GABRA2
SCHEMBL2655882 0.85 MTOR (0.36) GABRG2GABRB3GABRA2
SCHEMBL2657000 0.85 GABRG2 (0.46) GABRG2GABRB3GABRA2CYP3A4
SCHEMBL2657278 0.85 GABRG2 (0.32) GABRG2GABRB3GABRA2CYP3A4
SCHEMBL2661341 0.84 GABRG2 (0.38) GABRG2GABRB3GABRA2GABRA1GABRA5

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-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — US claimed
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — 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-20080318943-A1 Compounds and Uses Thereof - 848 COMT, BACE1, BDNF GABRG2 592/4885GABRB3 332/4885GABRA2 218/4885

“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.

Send feedback