SCHEMBL2661741

SCHEMBL2661741

CCCN1Cc2nc3c(-c4ccc(OC)cc4OC)c(F)ccc3c(N)c2C1=O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GABRG2 P18507 6/20 0.51
▸ GABRB3 P28472 6/20 0.51
▸ GABRA2 P47869 6/20 0.51
▸ MAPT P10636 1/20 0.40
▸ CRHR1 P34998 7/20 0.38
▸ PDE5A O76074 1/20 0.37
▸ PDE4A P27815 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ ADORA3 P0DMS8 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ HSP90AB1 P08238 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
SCHEMBL2657010 0.93 GABRG2 (0.51) GABRG2GABRB3GABRA2MAPTCRHR1
SCHEMBL4920872 0.86 CRHR1 (0.47) GABRG2GABRB3GABRA2MAPTCRHR1
SCHEMBL2660973 0.86 GABRG2 (0.52) GABRG2GABRB3GABRA2PDE5APDE4A
SCHEMBL2661405 0.85 GABRG2 (0.42) GABRG2GABRB3GABRA2PDE5APDE4A
SCHEMBL2658808 0.84 GABRG2 (0.44) GABRG2GABRB3GABRA2PDE5A
SCHEMBL2661083 0.84 TP53 (0.38) GABRG2GABRB3GABRA2PDE5APDE4A
SCHEMBL2655372 0.84 GABRG2 (0.40) GABRG2GABRB3GABRA2MAPTCRHR1
SCHEMBL2656082 0.83 GABRG2 (0.46) GABRG2GABRB3GABRA2MAPTPDE4A
SCHEMBL4922967 0.83 GABRG2 (0.39) GABRG2GABRB3GABRA2MAPTCRHR1
SCHEMBL2661245 0.83 MAPT (0.39) GABRG2GABRB3GABRA2MAPTCRHR1

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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