SCHEMBL2662121

SCHEMBL2662121

Cc1ccc(-c2cccc3c(N)c4c(nc23)CN(C2CC2)C4=O)c(Cl)n1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.34
▸ NPY1R P25929 1/20 0.33
▸ NPY5R Q15761 1/20 0.33
▸ CRHR1 P34998 3/20 0.31
▸ MAOA P21397 2/20 0.31
▸ PARP2 Q9UGN5 1/20 0.30
▸ ACHE P22303 1/20 0.30
▸ GRM5 P41594 1/20 0.30

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
SCHEMBL2661112 0.96 BMPR1A (0.32) MAPK1NPY1RNPY5RCRHR1ACHE
SCHEMBL2656990 0.88 MAPK1 (0.39) MAPK1NPY1RNPY5RMAOAPARP2
SCHEMBL2661432 0.86 MAPK1 (0.34) MAPK1NPY1RNPY5RMAOAPARP2
SCHEMBL2661491 0.85 MAPK1 (0.35) MAPK1NPY1RNPY5RGRM5
SCHEMBL4924467 0.84 HRH4 (0.41) MAPK1NPY1RNPY5RMAOAPARP2
SCHEMBL2657367 0.82 MTOR (0.38) MAPK1
SCHEMBL2655502 0.82 HTT (0.35) MAPK1CRHR1PARP2
SCHEMBL2661113 0.82 CRHR1 (0.31) CRHR1
SCHEMBL2660942 0.81 MAPK1 (0.35) MAPK1CRHR1ACHEGRM5
SCHEMBL2661944 0.81 MAPK1 (0.47) MAPK1NPY1RNPY5RMAOAGRM5

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 MAPK1 3191/4885NPY1R 126/4885NPY5R 104/4885

“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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