SCHEMBL2660960

SCHEMBL2660960

COc1ccc(-c2c(F)ccc3c(N)c4c(nc23)CN(C2CC2)C4=O)cc1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 2/20 0.41
▸ CNR1 P21554 1/20 0.37
▸ NPY1R P25929 1/20 0.36
▸ NPY5R Q15761 1/20 0.36
▸ GABRG2 P18507 2/20 0.36
▸ GABRB3 P28472 2/20 0.36
▸ GABRA2 P47869 2/20 0.36
▸ CA1 P00915 4/20 0.36
▸ CA2 P00918 4/20 0.36
▸ PIK3CD O00329 1/20 0.35
▸ PIK3CA P42336 1/20 0.35
▸ BCL9 O00512 1/20 0.35
▸ CTNNB1 P35222 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ PTPN11 Q06124 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ PTGS2 P35354 1/20 0.34

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
SCHEMBL2661662 0.96 CNR1 (0.39) PDE4ACNR1NPY1RNPY5RGABRG2
SCHEMBL2655742 0.90 PDE4A (0.37) PDE4ANPY1RNPY5RGABRG2GABRB3
SCHEMBL4916018 0.86 GABRG2 (0.43) PDE4ANPY1RNPY5RGABRG2GABRB3
SCHEMBL2655799 0.85 GABRG2 (0.52) PDE4ANPY1RNPY5RGABRG2GABRB3
SCHEMBL2661842 0.85 GABRG2 (0.42) PDE4ANPY1RNPY5RGABRG2GABRB3
SCHEMBL2661051 0.85 MAPK1 (0.38) PDE4ANPY1RNPY5RGABRG2GABRB3
SCHEMBL2656086 0.84 PDE5A (0.41) PDE4AGABRG2GABRB3GABRA2CA1
SCHEMBL2669536 0.84 NPY1R (0.41) PDE4ANPY1RNPY5RGABRG2GABRB3
SCHEMBL2656082 0.84 GABRG2 (0.46) PDE4ANPY1RNPY5RGABRG2GABRB3
SCHEMBL2669391 0.83 GABRG2 (0.44) NPY1RNPY5RGABRG2GABRB3GABRA2

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 PDE4A 639/4885CNR1 443/4885NPY1R 126/4885

“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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