SCHEMBL4123909

SCHEMBL4123909

CN1CCN(CCCN(CCNC(=O)Nc2ccc(C(F)(F)F)cc2)C(=O)Nc2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CCR3 P51677 4/20 0.52
▸ CA1 P00915 1/20 0.52
▸ CA2 P00918 1/20 0.52
▸ CA7 P43166 1/20 0.52
▸ CNR1 P21554 1/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ EPHX2 P34913 8/20 0.49
▸ ALDH1A1 P00352 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ DRD2 P14416 1/20 0.45
▸ DRD4 P21917 1/20 0.45
▸ MCHR1 Q99705 1/20 0.45

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
SCHEMBL4108824 0.95 CCR3 (0.48) CCR3CA1CA2CA7CNR1
SCHEMBL4112177 0.92 EPHX2 (0.59) CCR3CA1CA2CA7CNR1
SCHEMBL4124710 0.91 PKM (0.50) CCR3CNR1KMT2AEPHX2ALDH1A1
SCHEMBL4129069 0.88 DRD2 (0.45) EPHX2DRD2DRD4
SCHEMBL4118371 0.87 EPHX2 (0.54) CCR3CA1CA2CA7CNR1
SCHEMBL4123912 0.85 EPHX2 (0.61) CCR3CA1CA2CA7CNR1
SCHEMBL30416677 0.84 CNR1 (0.70) CCR3CA1CA2CA7CNR1
SCHEMBL4128123 0.84 EPHX2 (0.59) CCR3CA1CA2CA7CNR1
SCHEMBL4128421 0.83 EPHX2 (0.55) CCR3CNR1KMT2AEPHX2TSHR
SCHEMBL4119717 0.82 EPHX2 (0.57) CCR3CA1CA2CA7CNR1

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-20090118330-A1 Diurea derivatives ACTIVE BIOTECH AB (SE) 2009-05-07 — — US disclosed
EP-1711175-A1 DIUREA DERIVATIVES Active Biotech AB (SE) 2006-10-18 — — EP disclosed
WO-2005074919-A1 DIUREA DERIVATIVES ACTIVE BIOTECH AB (SE) 2005-08-18 — — 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-20090118330-A1 Diurea derivatives IL2, CASP2, MAVS CCR3 675/4885CA1 4022/4885CA2 1456/4885

“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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