SCHEMBL4921007

SCHEMBL4921007

Nc1c2c(nc3c(-c4ccc(F)nc4F)cccc13)CN(C1CCC1)C2=O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.36
▸ GRM5 P41594 2/20 0.34
▸ GRM1 Q13255 1/20 0.34
▸ POLB P06746 2/20 0.33
▸ PARP1 P09874 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ CDK4 P11802 1/20 0.32
▸ NPY1R P25929 1/20 0.31
▸ NPY5R Q15761 1/20 0.31
▸ MAOA P21397 2/20 0.31
▸ PARP2 Q9UGN5 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
SCHEMBL2661491 0.90 MAPK1 (0.35) MAPK1GRM5POLBPARP1HTT
SCHEMBL4923597 0.90 MAPK1 (0.35) MAPK1GRM5POLBPARP1HTT
SCHEMBL2669424 0.88 MAPK1 (0.36) MAPK1GRM5GRM1POLBPARP1
SCHEMBL2660877 0.87 MAPK1 (0.43) MAPK1GRM5POLBPARP1HTT
SCHEMBL2656990 0.86 MAPK1 (0.39) MAPK1GRM5GRM1NPY1RNPY5R
SCHEMBL2669539 0.83 MAPK1 (0.36) MAPK1GRM5GRM1POLBPARP1
SCHEMBL4920996 0.83 MAPK1 (0.37) MAPK1GRM5POLBPARP1HTT
SCHEMBL4921068 0.83 NPY1R (0.39) MAPK1POLBNPY1RNPY5R
SCHEMBL2661944 0.83 MAPK1 (0.47) MAPK1GRM5POLBPARP1HTT
SCHEMBL2669595 0.83 MAPK1 (0.47) MAPK1GRM5POLBPARP1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — US 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 MAPK1 3191/4885GRM5 222/4885GRM1 138/4885

“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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