SCHEMBL4201714

SCHEMBL4201714

NC(=O)c1nnc(N2CCN(CCN3CCCC3)CC2)nc1NCc1ccc(Cl)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.43
CCR4 P51679 11/20 0.43
CD38 P28907 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL4205431 0.87 NPSR1 (0.43) EPHX2CCR4ALDH1A1
SCHEMBL13780307 0.86 CCR4 (0.44) EPHX2CCR4CD38
SCHEMBL13780314 0.85 CCR4 (0.46) EPHX2CCR4CD38
SCHEMBL13780157 0.84 EPHX2 (0.45) EPHX2CCR4
SCHEMBL4201718 0.84 KDM4E (0.40) EPHX2CCR4KDM4EALDH1A1POLB
SCHEMBL13780308 0.84 CCR4 (0.40) EPHX2CCR4CD38
SCHEMBL4975648 0.83 CCR4 (0.44) EPHX2CCR4ALDH1A1
SCHEMBL13780152 0.82 EPHX2 (0.52) EPHX2CCR4
SCHEMBL13780154 0.82 EPHX2 (0.52) EPHX2CCR4
SCHEMBL13780107 0.81 EPHX2 (0.51) EPHX2CCR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090182140-A1 Alicyclic Heterocyclic Compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-07-16 US 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-20090182140-A1 Alicyclic Heterocyclic Compound CCR4, CCR1, HRH4 EPHX2 265/4885CCR4 1/4885CD38 2548/4885

“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.