SCHEMBL2661563

SCHEMBL2661563

Cc1cc(-c2cccc3c(N)c4c(nc23)CN(C2CCC2)C4=O)cnc1F

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ACVR1 Q04771 11/20 0.38
▸ BMPR1A P36894 10/20 0.38
▸ ACVRL1 P37023 10/20 0.38
▸ MAPK1 P28482 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ PIK3CA P42336 4/20 0.33
▸ PIK3CG P48736 1/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ PDE4A P27815 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
SCHEMBL2669425 0.89 PIK3CA (0.38) ACVR1BMPR1AACVRL1PIK3CAMTOR
SCHEMBL2669594 0.86 BMPR1A (0.40) ACVR1BMPR1AACVRL1POLBPIK3CA
SCHEMBL4920996 0.85 MAPK1 (0.37) ACVR1BMPR1AACVRL1MAPK1LMNA
SCHEMBL2662222 0.85 MTOR (0.38) ACVR1BMPR1AACVRL1PIK3CAPIK3CG
SCHEMBL2661491 0.83 MAPK1 (0.35) ACVR1BMPR1AACVRL1MAPK1LMNA
SCHEMBL2661202 0.82 TSHR (0.35) ACVR1BMPR1AACVRL1MAPK1POLB
SCHEMBL2669424 0.82 MAPK1 (0.36) ACVR1BMPR1AACVRL1MAPK1POLB
SCHEMBL2657367 0.82 MTOR (0.38) ACVR1BMPR1AACVRL1MAPK1PIK3CA
SCHEMBL2657685 0.82 BTK (0.30) —
SCHEMBL2669535 0.82 PIK3CA (0.46) PIK3CAMTOR

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
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — US 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
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 ACVR1 4057/4885BMPR1A 1929/4885ACVRL1 3949/4885

“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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