SCHEMBL2657499

SCHEMBL2657499

CCN1Cc2nc3c(Br)cccc3c(N)c2C1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH4 Q9H3N8 1/20 0.38
▸ PDE5A O76074 7/20 0.37
▸ CYP1B1 Q16678 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ ADORA1 P30542 1/20 0.33
▸ GRM2 Q14416 1/20 0.33
▸ PRNP P04156 1/20 0.32
▸ CHRNE Q04844 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ ACHE P22303 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ KEAP1 Q14145 1/20 0.31
▸ NFE2L2 Q16236 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
SCHEMBL2655615 0.91 LMNA (0.41) HRH4ALDH1A1ADORA1GRM2KDM4E
SCHEMBL2662460 0.89 GRM2 (0.38) HRH4PDE5AALDH1A1GRM2KDM4E
SCHEMBL2655216 0.84 HRH4 (0.42) HRH4ALDH1A1ADORA1CHRNEKDM4E
SCHEMBL2655999 0.82 MEN1 (0.40) PDE5AKDM4EGAAMEN1KMT2A
SCHEMBL2656693 0.82 PDE5A (0.34) PDE5A
SCHEMBL2656853 0.81 HRH4 (0.38) HRH4ALDH1A1ADORA1KDM4EGLA
SCHEMBL2656531 0.80 KMT2A (0.41) PDE5AALDH1A1MEN1KMT2A
SCHEMBL2661396 0.80 PDE5A (0.43) PDE5AALDH1A1ADORA1ACHEMEN1
SCHEMBL2659840 0.80 GABRG2 (0.43) PDE5ACYP1B1ALDH1A1KDM4EGAA
SCHEMBL2659013 0.79 KDM4E (0.41) PDE5AALDH1A1KDM4E

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 HRH4 167/4885PDE5A 742/4885CYP1B1 672/4885

“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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