SCHEMBL2657657

SCHEMBL2657657

COc1ccc(CN2Cc3nc4c(Br)cccc4c(N)c3C2=O)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 11/20 0.50
▸ PDE6C P51160 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ ADORA2A P29274 1/20 0.39
▸ CYP3A4 P08684 1/20 0.38
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ HCRTR1 O43613 1/20 0.35
▸ HCRTR2 O43614 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ YTHDC1 Q96MU7 1/20 0.35
▸ PTGER4 P35408 1/20 0.35

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
SCHEMBL2656531 0.92 KMT2A (0.41) PDE5AALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL2655999 0.87 MEN1 (0.40) PDE5AKDM4ENPSR1MEN1KMT2A
SCHEMBL2662451 0.86 PDE5A (0.46) PDE5APDE6CKDM4EALDH1A1THRB
SCHEMBL2661969 0.85 PDE5A (0.45) PDE5APDE6CKDM4EALDH1A1THRB
SCHEMBL2659013 0.83 KDM4E (0.41) PDE5AKDM4EALDH1A1NPSR1
SCHEMBL2661248 0.79 GABRG2 (0.45) PDE5AKDM4EALDH1A1SMN1; SMN2MEN1
SCHEMBL2656453 0.79 MEN1 (0.41) PDE5AALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL2661198 0.79 KMT2A (0.42) ALDH1A1SMN1; SMN2TDP1MEN1KMT2A
SCHEMBL2656131 0.78 TNIK (0.39) PDE5AMEN1KMT2APOLB
SCHEMBL2657499 0.78 HRH4 (0.38) PDE5AKDM4EALDH1A1MEN1KMT2A

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 3 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 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 PDE5A 742/4885PDE6C 2133/4885KDM4E 2357/4885

“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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