SCHEMBL2661817

SCHEMBL2661817

COc1ccc(CN2Cc3nc4c(-c5cc(C)ccc5OC)cccc4c(N)c3C2=O)cc1OC

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GABRG2 P18507 2/20 0.43
▸ GABRB3 P28472 2/20 0.43
▸ GABRA2 P47869 2/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.42
▸ LMNA P02545 3/20 0.42
▸ MEN1 O00255 7/20 0.39
▸ KMT2A Q03164 7/20 0.39
▸ MAPT P10636 3/20 0.39
▸ PDE5A O76074 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.36
▸ TP53 P04637 2/20 0.36
▸ UTS2R Q9UKP6 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HTT P42858 1/20 0.36

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
SCHEMBL2661116 0.92 GABRG2 (0.42) GABRG2GABRB3GABRA2PDE5AALDH1A1
SCHEMBL2658867 0.91 MEN1 (0.45) GABRG2GABRB3GABRA2SMN1; SMN2MEN1
SCHEMBL2662287 0.90 ALDH1A1 (0.41) GABRG2GABRB3GABRA2SMN1; SMN2LMNA
SCHEMBL2660894 0.89 GABRG2 (0.42) GABRG2GABRB3GABRA2SMN1; SMN2LMNA
SCHEMBL4922136 0.88 GABRG2 (0.48) GABRG2GABRB3GABRA2SMN1; SMN2PDE5A
SCHEMBL2661338 0.88 MEN1 (0.40) SMN1; SMN2LMNAMEN1KMT2AMAPT
SCHEMBL2661502 0.87 MEN1 (0.38) SMN1; SMN2LMNAMEN1KMT2AMAPT
SCHEMBL2661536 0.87 GABRG2 (0.49) GABRG2GABRB3GABRA2MAPTPDE5A
SCHEMBL2656453 0.87 MEN1 (0.41) SMN1; SMN2LMNAMEN1KMT2AMAPT
SCHEMBL2661915 0.86 MEN1 (0.38) SMN1; SMN2LMNAMEN1KMT2AMAPT

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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