SCHEMBL2660894

SCHEMBL2660894

COc1ccc(CN2Cc3nc4c(-c5cnccc5OC)cccc4c(N)c3C2=O)cc1OC

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GABRG2 P18507 1/20 0.42
▸ GABRB3 P28472 1/20 0.42
▸ GABRA2 P47869 1/20 0.42
▸ LMNA P02545 4/20 0.41
▸ MEN1 O00255 7/20 0.39
▸ KMT2A Q03164 7/20 0.39
▸ PDE5A O76074 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ CREBBP Q92793 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ UTS2R Q9UKP6 3/20 0.36
▸ TNIK Q9UKE5 1/20 0.35
▸ MAPK1 P28482 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
SCHEMBL2661359 0.91 TNIK (0.42) GABRG2GABRB3GABRA2LMNAMEN1
SCHEMBL2661373 0.91 GABRG2 (0.43) GABRG2GABRB3GABRA2LMNAMEN1
SCHEMBL2658867 0.89 MEN1 (0.45) GABRG2GABRB3GABRA2MEN1KMT2A
SCHEMBL2661817 0.89 GABRG2 (0.43) GABRG2GABRB3GABRA2LMNAMEN1
SCHEMBL2661227 0.89 GABRG2 (0.41) GABRG2GABRB3GABRA2LMNAMEN1
SCHEMBL2661915 0.87 MEN1 (0.38) LMNAMEN1KMT2APDE5AMAPT
SCHEMBL2657235 0.87 GABRG2 (0.41) GABRG2GABRB3GABRA2MEN1KMT2A
SCHEMBL2656832 0.87 GABRG2 (0.49) GABRG2GABRB3GABRA2MEN1KMT2A
SCHEMBL2661338 0.86 MEN1 (0.40) LMNAMEN1KMT2APDE5AMAPT
SCHEMBL2661256 0.85 GABRG2 (0.43) GABRG2GABRB3GABRA2LMNAMEN1

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 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.

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