SCHEMBL6080372

SCHEMBL6080372

CC(C)(C)OC(=O)NC1CCN(CC(c2ccccc2)c2ccccc2)C1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 2/20 0.56
KCNA3 P22001 1/20 0.55
KMT2A Q03164 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
DRD2 P14416 2/20 0.48
CTSK P43235 2/20 0.48
CKS1B P61024 1/20 0.47
SKP1 P63208 1/20 0.47
SKP2 Q13309 1/20 0.47
KDM1A O60341 1/20 0.46
MAOB P27338 1/20 0.46
NAMPT P43490 1/20 0.45
HRH2 P25021 3/20 0.45
HRH1 P35367 3/20 0.45
PIM1 P11309 1/20 0.45
PIM3 Q86V86 1/20 0.45
PIM2 Q9P1W9 1/20 0.45
USP14 P54578 1/20 0.44
BACE1 P56817 1/20 0.44
KDM4D Q6B0I6 2/20 0.44

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
SCHEMBL6080067 1.00 CCR5 (0.56) CCR5KCNA3KMT2AL3MBTL1DRD2
SCHEMBL6079046 0.92 CCR5 (0.60) CCR5KCNA3KMT2AL3MBTL1DRD2
SCHEMBL6079039 0.92 CCR5 (0.60) CCR5KCNA3KMT2AL3MBTL1DRD2
SCHEMBL15385478 0.90 CCR5 (0.54) CCR5KCNA3KMT2AL3MBTL1DRD2
SCHEMBL3643801 0.88 CCR5 (0.67) CCR5KCNA3DRD2CKS1BSKP1
SCHEMBL13857678 0.84 KCNA3 (0.52) CCR5KCNA3KMT2AL3MBTL1DRD2
SCHEMBL11969521 0.84 KCNA3 (0.58) CCR5KCNA3KMT2AL3MBTL1DRD2
SCHEMBL2241424 0.83 KMT2A (0.63) KCNA3KMT2AL3MBTL1DRD2BACE1
SCHEMBL2241423 0.83 KMT2A (0.63) KCNA3KMT2AL3MBTL1DRD2BACE1
SCHEMBL178929 0.83 KMT2A (0.63) KCNA3KMT2AL3MBTL1DRD2BACE1

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
US-20060094716-A1 1-Pyridin-4-yl-urea derivatives ACTELION PHARMACEUTICALS LTD (CH) 2006-05-04 US disclosed
EP-1554249-A2 1-PYRIDIN-4-YL-UREA DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2005-07-20 EP disclosed
WO-2004026836-A2 1-PYRIDIN-4-YL-UREA DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2004-04-01 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-20060094716-A1 1-Pyridin-4-yl-urea derivatives P2RY4, P2RX4, REN CCR5 2074/4885KCNA3 536/4885KMT2A 3136/4885

“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.