SCHEMBL2661560

SCHEMBL2661560

CCCN1Cc2nc3c(-c4cccc(OC)c4)cccc3c(N)c2C1=O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.40
▸ ADORA2A P29274 1/20 0.39
▸ ADORA1 P30542 1/20 0.39
▸ BACE1 P56817 6/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ TLR8 Q9NR97 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ PIK3CA P42336 1/20 0.37
▸ HRH4 Q9H3N8 1/20 0.37
▸ DPP4 P27487 1/20 0.36
▸ ALOX5 P09917 1/20 0.36
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL4920722 0.93 KDM4E (0.43) ADORA2AADORA1BACE1KDM4EALDH1A1
SCHEMBL4919239 0.90 KDM4E (0.37) BACE1KDM4EALDH1A1TSHRMAPT
SCHEMBL4924170 0.88 TP53 (0.42) KDM4EALDH1A1TSHRMAPTHRH4
SCHEMBL2660678 0.87 GABRG2 (0.45) BACE1ALDH1A1TLR8HRH4KMT2A
SCHEMBL2660713 0.87 HRH4 (0.42) ADORA2AADORA1KDM4EALDH1A1HRH4
SCHEMBL4920872 0.87 CRHR1 (0.47) KDM4EALDH1A1TSHRMAPT
SCHEMBL2661245 0.86 MAPT (0.39) KDM4EALDH1A1TSHRMAPTKMT2A
SCHEMBL4922967 0.86 GABRG2 (0.39) KDM4EALDH1A1TSHRMAPTKMT2A
SCHEMBL2661065 0.86 ALDH1A1 (0.40) KDM4EALDH1A1TSHRMAPTHRH4
SCHEMBL2661141 0.85 PDE5A (0.40) ADORA2AADORA1BACE1KDM4EALDH1A1

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 BRD4 1608/4885ADORA2A 440/4885ADORA1 694/4885

“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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