SCHEMBL2660324

SCHEMBL2660324

CCCN1Cc2nc3c(-c4ccc(OC)cc4C(F)(F)F)cccc3c(N)c2C1=O

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.37
▸ GABRG2 P18507 6/20 0.35
▸ GABRB3 P28472 6/20 0.35
▸ GABRA2 P47869 6/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ GABRA1 P14867 1/20 0.35
▸ GABRA5 P31644 1/20 0.35
▸ GABRA3 P34903 1/20 0.35
▸ CRHR1 P34998 3/20 0.35
▸ ENPP1 P22413 2/20 0.35
▸ ENPP3 O14638 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ LIMK1 P53667 1/20 0.34
▸ PDE5A O76074 1/20 0.33
▸ EPHX2 P34913 1/20 0.33

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
SCHEMBL2661245 0.89 MAPT (0.39) MAPTGABRG2GABRB3GABRA2KDM4E
SCHEMBL4920872 0.88 CRHR1 (0.47) MAPTGABRG2GABRB3GABRA2KDM4E
SCHEMBL2661809 0.88 TLR8 (0.37) ALDH1A1
SCHEMBL4922967 0.87 GABRG2 (0.39) MAPTGABRG2GABRB3GABRA2KDM4E
SCHEMBL2661560 0.84 BRD4 (0.40) MAPTKDM4EALDH1A1TSHRKMT2A
SCHEMBL2661504 0.84 PDE4A (0.37) GABRG2GABRB3GABRA2ENPP1ENPP3
SCHEMBL2661065 0.83 ALDH1A1 (0.40) MAPTGABRG2GABRB3GABRA2KDM4E
SCHEMBL4920722 0.83 KDM4E (0.43) MAPTGABRG2GABRB3GABRA2KDM4E
SCHEMBL2661594 0.82 USP1 (0.40) MAPTKDM4EENPP1ENPP3MEN1
SCHEMBL4921356 0.82 GABRG2 (0.37) MAPTGABRG2GABRB3GABRA2KDM4E

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 MAPT 4/4885GABRG2 592/4885GABRB3 332/4885

“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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