SCHEMBL2661258

SCHEMBL2661258

N#Cc1cc(F)ccc1-c1cccc2c(N)c3c(nc12)CN(C1CCC1)C3=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 7/20 0.36
▸ MAPK1 P28482 1/20 0.35
▸ TP53 P04637 1/20 0.34
▸ POLB P06746 2/20 0.34
▸ MAPT P10636 1/20 0.34
▸ CYP3A4 P08684 1/20 0.32
▸ DPP4 P27487 1/20 0.32
▸ PIK3R1 P27986 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ PIK3CB P42338 1/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ PDE4A P27815 3/20 0.31
▸ PDE4D Q08499 2/20 0.31
▸ PDE4C Q08493 1/20 0.31
▸ PIK3R2 O00459 1/20 0.31
▸ ABL1 P00519 1/20 0.31
▸ JAK2 O60674 1/20 0.31
▸ NR1I2 O75469 1/20 0.31
▸ SLC34A2 O95436 1/20 0.31

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
SCHEMBL2661485 0.93 MAPK1 (0.35) PIK3CDMAPK1TP53POLBMAPT
SCHEMBL2661561 0.89 CDK4 (0.37) PIK3CDMAPK1POLBCYP3A4DPP4
SCHEMBL2661381 0.87 CDK4 (0.39) MAPK1POLBDPP4ACVR1
SCHEMBL2661001 0.85 MAPK1 (0.38) MAPK1MAPTCYP3A4DPP4PDE4A
SCHEMBL2669596 0.84 PDE4A (0.42) MAPK1TP53POLBMAPTDPP4
SCHEMBL4919174 0.84 NPY1R (0.40) MAPK1TP53POLBMAPTALK
SCHEMBL2669504 0.82 GABRG2 (0.41) POLBMAPTDPP4PIK3CA
SCHEMBL2661260 0.82 PIK3CA (0.36) PIK3CDTP53POLBTHRBPIK3CA
SCHEMBL2661337 0.82 PDE4A (0.42) MAPK1TP53POLBMAPTCYP3A4
SCHEMBL4920996 0.82 MAPK1 (0.37) PIK3CDMAPK1TP53POLBMAPT

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101778849-A Fused quinoline derivatives useful as gaba modulators ASTRAZENECA AB 2010-07-14 — — CN claimed
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
CN-101778849-A Fused quinoline derivatives useful as gaba modulators ASTRAZENECA AB 2010-07-14 — — CN disclosed
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
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
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 PIK3CD 3863/4885MAPK1 3191/4885TP53 1103/4885

“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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