SCHEMBL4922995

SCHEMBL4922995

COc1ccc(-c2c(F)ccc3c(N)c4c(nc23)CN(C2CCC2)C4=O)c(C)n1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GABRG2 P18507 4/20 0.42
▸ GABRB3 P28472 4/20 0.42
▸ GABRA2 P47869 4/20 0.42
▸ PIK3CA P42336 6/20 0.35
▸ MTOR P42345 4/20 0.35
▸ BRD9 Q9H8M2 1/20 0.34
▸ BRD7 Q9NPI1 1/20 0.34
▸ MAOA P21397 2/20 0.33
▸ P2RX7 Q99572 3/20 0.32
▸ BMPR1A P36894 1/20 0.31
▸ ACVRL1 P37023 1/20 0.31
▸ ACVR1 Q04771 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
SCHEMBL2660485 0.91 GABRG2 (0.51) GABRG2GABRB3GABRA2PIK3CAMTOR
SCHEMBL4919925 0.88 GABRG2 (0.53) GABRG2GABRB3GABRA2BRD9BRD7
SCHEMBL2669400 0.86 PIK3CA (0.35) PIK3CAMTORBRD9BRD7MAOA
SCHEMBL2669389 0.85 PIK3CA (0.38) GABRG2GABRB3GABRA2PIK3CAMTOR
SCHEMBL2660640 0.84 PIK3CA (0.42) GABRG2GABRB3GABRA2PIK3CAMTOR
SCHEMBL2660625 0.84 GABRG2 (0.39) GABRG2GABRB3GABRA2PIK3CA
SCHEMBL2669390 0.84 GABRG2 (0.40) GABRG2GABRB3GABRA2PIK3CA
SCHEMBL2669388 0.84 GABRG2 (0.46) GABRG2GABRB3GABRA2
SCHEMBL2659925 0.83 GABRG2 (0.46) GABRG2GABRB3GABRA2
SCHEMBL2669391 0.82 GABRG2 (0.44) GABRG2GABRB3GABRA2PIK3CA

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 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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