SCHEMBL6079514

SCHEMBL6079514

CCc1cc(NC(=O)NC2CCN(CC(c3ccccc3)c3ccccc3)C2)cc(C)n1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.45
DCUN1D1 Q96GG9 1/20 0.44
CXCR3 P49682 2/20 0.43
KMT2A Q03164 2/20 0.43
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
DRD3 P35462 1/20 0.43
EPHX2 P34913 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM5A P29375 1/20 0.40
KDM5B Q9UGL1 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL6079504 1.00 CCR3 (0.45) CCR3DCUN1D1CXCR3KMT2ADRD2
SCHEMBL6079627 0.94 CXCR3 (0.45) CCR3DCUN1D1CXCR3KMT2ADRD2
SCHEMBL6079618 0.94 CXCR3 (0.45) CCR3DCUN1D1CXCR3KMT2ADRD2
SCHEMBL6079351 0.93 CXCR3 (0.44) CCR3DCUN1D1CXCR3KMT2ADRD2
SCHEMBL6079357 0.93 CXCR3 (0.44) CCR3DCUN1D1CXCR3KMT2ADRD2
SCHEMBL6079793 0.92 CCR3 (0.49) CCR3DCUN1D1CXCR3KMT2ADRD2
SCHEMBL6079782 0.92 CCR3 (0.49) CCR3DCUN1D1CXCR3KMT2ADRD2
SCHEMBL6079687 0.90 CXCR3 (0.50) CCR3DCUN1D1CXCR3KMT2ADRD2
SCHEMBL6079676 0.90 CXCR3 (0.50) CCR3DCUN1D1CXCR3KMT2ADRD2
SCHEMBL6079223 0.86 CXCR3 (0.46) CCR3DCUN1D1CXCR3KMT2ADRD2

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
US-20060094716-A1 1-Pyridin-4-yl-urea derivatives ACTELION PHARMACEUTICALS LTD (CH) 2006-05-04 US claimed
EP-1554249-A2 1-PYRIDIN-4-YL-UREA DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2005-07-20 EP claimed
WO-2004026836-A2 1-PYRIDIN-4-YL-UREA DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2004-04-01 WO claimed
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 CCR3 3917/4885DCUN1D1 2861/4885CXCR3 3447/4885

“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.