SCHEMBL2657148

SCHEMBL2657148

COc1ccc(-c2c(F)ccc3c(N)c4c(nc23)CN(C2=CC=C2)C4=O)cn1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 7/20 0.35
▸ PIK3CA P42336 14/20 0.34
▸ CHRM1 P11229 2/20 0.33
▸ ERN1 O75460 1/20 0.32
▸ GABRG2 P18507 1/20 0.32
▸ GABRB3 P28472 1/20 0.32
▸ GABRA2 P47869 1/20 0.32
▸ DPP4 P27487 1/20 0.32
▸ DPP8 Q6V1X1 1/20 0.32
▸ DPP7 Q9UHL4 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
SCHEMBL2658514 0.88 — —
SCHEMBL2658045 0.87 GABRG2 (0.34) MTORPIK3CAGABRG2GABRB3GABRA2
SCHEMBL2655858 0.85 PIK3CA (0.38) MTORPIK3CA
SCHEMBL2658291 0.85 CA1 (0.35) PIK3CAGABRG2GABRB3GABRA2
SCHEMBL2656719 0.84 GABRG2 (0.39) GABRG2GABRB3GABRA2
SCHEMBL2660488 0.84 GABRG2 (0.48) GABRG2GABRB3GABRA2
SCHEMBL2660640 0.81 PIK3CA (0.42) MTORPIK3CAERN1GABRG2GABRB3
SCHEMBL2659065 0.81 GABRG2 (0.34) GABRG2GABRB3GABRA2
SCHEMBL2658971 0.80 GABRG2 (0.39) GABRG2GABRB3GABRA2DPP4
SCHEMBL2660626 0.80 GABRG2 (0.37) GABRG2GABRB3GABRA2DPP4

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2176263-A2 FUSED QUINOLINE DERIVATIVES USEFUL AS GABA MODULATORS AstraZeneca AB (SE) 2010-04-21 — — EP claimed
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — US claimed
WO-2008155572-A2 FUSED QUINOLINE DERIVATIVES USEFUL AS GABA MODULATORS ASTRAZENECA AB (SE) 2008-12-24 — — WO claimed
EP-2176263-A2 FUSED QUINOLINE DERIVATIVES USEFUL AS GABA MODULATORS AstraZeneca AB (SE) 2010-04-21 — — EP disclosed
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — US disclosed
WO-2008155572-A2 FUSED QUINOLINE DERIVATIVES USEFUL AS GABA MODULATORS ASTRAZENECA AB (SE) 2008-12-24 — — WO 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 MTOR 2672/4885PIK3CA 3396/4885CHRM1 17/4885

“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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