SCHEMBL5572452

SCHEMBL5572452

CC(C)(C)OC(=O)N1CCC(N2C(=O)N(C(C)(C)C)CC2c2ccccc2Cl)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STS P08842 4/20 0.45
MAPT P10636 2/20 0.45
KDM4E B2RXH2 2/20 0.45
THRB P10828 1/20 0.45
KCNH2 Q12809 1/20 0.44
SCN5A Q14524 1/20 0.44
SCN9A Q15858 1/20 0.44
GPR119 Q8TDV5 2/20 0.43
PRKCG P05129 1/20 0.42
PRKCB P05771 1/20 0.42
PRKCA P17252 1/20 0.42
PRKCH P24723 1/20 0.42
PRKCE Q02156 1/20 0.42
PRKCD Q05655 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TP53 P04637 1/20 0.41
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
PTPN6 P29350 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
SCHEMBL4596490 0.85 GPR119 (0.49) STSMAPTKDM4ETHRBKCNH2
SCHEMBL4596495 0.85 GPR119 (0.49) STSMAPTKDM4ETHRBKCNH2
SCHEMBL5572460 0.84 STS (0.47) STSMAPTKDM4ETHRBMEN1
SCHEMBL5572456 0.82 STS (0.48) STSMAPTKDM4ETHRBGPR119
SCHEMBL4610211 0.82 CCR5 (0.37)
SCHEMBL2160640 0.77 MEN1 (0.57) STSMAPTKDM4ETHRBGPR119
SCHEMBL5573862 0.74 GPR119 (0.44) STSMAPTKDM4ETHRBKCNH2
SCHEMBL5573869 0.74 GPR119 (0.44) STSMAPTKDM4ETHRBKCNH2
SCHEMBL5573931 0.72 GPR119 (0.48) STSMAPTKDM4ETHRBGPR119
SCHEMBL4597967 0.72 GPR119 (0.48) STSMAPTKDM4ETHRBGPR119

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-20070066624-A1 Chemokine receptor binding compounds ANORMED, INC. (CA) 2007-03-22 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-20070066624-A1 Chemokine receptor binding compounds CCR5, CCR4, CCR1 STS 4841/4885MAPT 3432/4885KDM4E 3689/4885

“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.