SCHEMBL12117397

SCHEMBL12117397

COC(=O)c1cccn1CCC(N)C(=O)N1CCC(C)CC1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR10 P46092 13/20 0.44
HPGD P15428 2/20 0.40
POLB P06746 1/20 0.39
GAA P10253 1/20 0.38
DPP7 Q9UHL4 2/20 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
Trifluoroacetic Acid SCHEMBL1076906 0.93 DPP4 (0.45) CCR10HPGDGAADPP7
SCHEMBL1312174 0.80 CCR10 (0.45) CCR10POLB
SCHEMBL4305633 0.79 CCR10 (0.64) CCR10
Hydrochloric Acid SCHEMBL1075046 0.78 CCR10 (0.63) CCR10
SCHEMBL29225360 0.73 LMNA (0.40) HPGD
Hydrochloric Acid SCHEMBL1311694 0.72 MTNR1A (0.47) CCR10HPGDDPP7
Hydrochloric Acid SCHEMBL1075496 0.71 CCR10 (0.46) CCR10HPGDDPP7
Hydrochloric Acid SCHEMBL1076272 0.71 CCR10 (0.59) CCR10HPGDDPP7
SCHEMBL28698896 0.70 MEN1 (0.40)
SCHEMBL12119926 0.70 CCR10 (0.45) CCR10HPGDDPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8586748-B2 2-sulfonylamino-4-heteroaryl butyramide antagonists of CCR10 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-11-19 US disclosed
US-20110275800-A1 2-SULFONYLAMINO-4-HETEROARYL BUTYRAMIDE ANTAGONISTS OF CCR10 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-10 US disclosed
US-20110275800-A1 2-SULFONYLAMINO-4-HETEROARYL BUTYRAMIDE ANTAGONISTS OF CCR10 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-10 US disclosed
WO-2009126675-A1 2-SULFONYLAMINO-4-HETEROARYL BUTYRAMIDE ANTAGONISTS OF CCR10 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-10-15 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-20110275800-A1 2-SULFONYLAMINO-4-HETEROARYL BUTYRAMIDE ANTAGONISTS OF CCR10 CCR10, CCR1, CCR4 CCR10 1/4885HPGD 2417/4885POLB 4695/4885

“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.