SCHEMBL2657367

SCHEMBL2657367

Cc1ccc(-c2cccc3c(N)c4c(nc23)CN(C2CC2)C4=O)cn1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 5/20 0.38
▸ AKT1 P31749 3/20 0.38
▸ GABRA1 P14867 3/20 0.38
▸ JUN P05412 2/20 0.38
▸ MAPK10 P53779 2/20 0.38
▸ BMPR1A P36894 2/20 0.37
▸ ACVRL1 P37023 2/20 0.37
▸ ACVR1 Q04771 2/20 0.37
▸ PDE4A P27815 2/20 0.35
▸ MAPK1 P28482 1/20 0.34
▸ PIK3CA P42336 2/20 0.34
▸ LCK P06239 1/20 0.33
▸ BTK Q06187 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
SCHEMBL2669594 0.96 BMPR1A (0.40) MTORAKT1GABRA1JUNMAPK10
SCHEMBL2661531 0.86 TSHR (0.38) MAPK10PDE4AMAPK1
SCHEMBL4924467 0.84 HRH4 (0.41) BMPR1AACVRL1ACVR1PDE4AMAPK1
SCHEMBL2662086 0.84 PIK3CA (0.46) MTORAKT1BMPR1AACVRL1ACVR1
SCHEMBL2669535 0.84 PIK3CA (0.46) MTORAKT1PIK3CA
SCHEMBL2662222 0.83 MTOR (0.38) MTORAKT1BMPR1AACVRL1ACVR1
SCHEMBL2661751 0.83 HSP90AA1 (0.37) MTORAKT1JUNMAPK10LCK
SCHEMBL2662121 0.82 MAPK1 (0.34) MAPK1
SCHEMBL2656990 0.82 MAPK1 (0.39) PDE4AMAPK1LCKBTK
SCHEMBL2661563 0.82 ACVR1 (0.38) MTORBMPR1AACVRL1ACVR1PDE4A

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 7 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
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — US disclosed
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — US 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 MTOR 2672/4885AKT1 1924/4885GABRA1 175/4885

“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.

Send feedback