SCHEMBL4586563

SCHEMBL4586563

Cc1cc(CO)cc2cccnc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 5/20 0.50
CCR8 P51685 5/20 0.50
CCR5 P51681 3/20 0.45
PSMD14 O00487 2/20 0.45
COPS5 Q92905 1/20 0.45
PRMT5 O14744 1/20 0.44
LMNA P02545 3/20 0.43
DYRK1A Q13627 1/20 0.43
L3MBTL1 Q9Y468 5/20 0.41
RIPK1 Q13546 1/20 0.41
KDM4E B2RXH2 4/20 0.41
HTT P42858 3/20 0.41
MMP2 P08253 2/20 0.41
TSHR P16473 2/20 0.41
GMNN O75496 1/20 0.41
TP53 P04637 1/20 0.41
HSP90AA1 P07900 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL9800644 0.86 CCR1 (0.50) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL24368249 0.84 CCR1 (0.51) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL4330878 0.84 CCR1 (0.45) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL3594386 0.81 SLC22A12 (0.46) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL21525701 0.80 CCR1 (0.47) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL21438696 0.79 KDM4E (0.41) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL4585400 0.79 CCR1 (0.50) CCR1CCR8CCR5LMNAL3MBTL1
SCHEMBL1223717 0.79 MEN1 (0.48) LMNADYRK1AL3MBTL1KDM4EHTT
SCHEMBL5544307 0.77 CCR1 (0.55) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL874272 0.76 PSMD14 (0.67) CCR1CCR8CCR5PSMD14COPS5

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214455-A1 Novel Chemical Compounds SMITHKLINE BEECHAM CORPORATION 2008-09-04 US disclosed
EP-1879563-A4 NOVEL CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2008-07-16 EP disclosed
EP-1879563-A2 NOVEL CHEMICAL COMPOUNDS Smithkline Beecham Corporation (US) 2008-01-23 EP disclosed
WO-2006132739-A2 NOVEL CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2006-12-14 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-20080214455-A1 Novel Chemical Compounds HIPK3, HIPK1, HIPK4 CCR1 4635/4885CCR8 4624/4885CCR5 4496/4885

“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.