SCHEMBL20130985

SCHEMBL20130985

CC(c1ccc(Cl)cc1Cl)n1ncc2ccc(N3CCN[C@H](C)C3)cc21

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 18/20 0.42
KHK P50053 2/20 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
SCHEMBL14995052 1.00 CCR4 (0.42) CCR4KHK
SCHEMBL14995051 1.00 CCR4 (0.42) CCR4KHK
SCHEMBL27978187 0.89 CCR4 (0.39) CCR4
SCHEMBL27978183 0.89 CCR4 (0.39) CCR4
SCHEMBL14994962 0.89 SOS1 (0.41) CCR4
SCHEMBL15053400 0.89 SOS1 (0.41) CCR4
SCHEMBL15692597 0.89 CCR4 (0.42) CCR4
SCHEMBL27978185 0.89 SOS1 (0.41) CCR4
SCHEMBL15053683 0.87 SOS1 (0.48) CCR4
SCHEMBL15053684 0.87 SOS1 (0.48) CCR4

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-10647696-B2 Substituted benzimidazoles and benzopyrazoles as CCR(4) antagonists CHEMOCENTRYX, INC. (US) 2020-05-12 US disclosed
US-20180127395-A1 SUBSTITUTED BENZIMIDAZOLES AND BENZOPYRAZOLES AS CCR(4) ANTAGONISTS CHEMOCENTRYX, INC. 2018-05-10 US disclosed
CN-103974950-A Substituted benzimidazoles and benzopyrazoles as CCR(4) antagonists CHEMOCENTRYX INC 2014-08-06 CN 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 (2 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-20180127395-A1 SUBSTITUTED BENZIMIDAZOLES AND BENZOPYRAZOLES AS CCR(4) ANTAGONISTS CCR4, CCR1, CCR3 CCR4 1/4885KHK 2687/4885
US-10647696-B2 Substituted benzimidazoles and benzopyrazoles as CCR(4) antagonists CCR4, CCR1, CCR3 CCR4 1/4885KHK 2687/4885

“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.