SCHEMBL7510130

SCHEMBL7510130

CCOC(=O)CCN1CCC(O)(c2ccc(Cl)cc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.59
ADRA1A P35348 2/20 0.59
CCR1 P32246 1/20 0.56
DRD4 P21917 2/20 0.55
DRD3 P35462 2/20 0.55
MEN1 O00255 1/20 0.54
CACNA1F O60840 1/20 0.54
KCNK2 O95069 1/20 0.54
ABCB11 O95342 1/20 0.54
CYP1A2 P05177 1/20 0.54
ADRB2 P07550 1/20 0.54
CHRM2 P08172 1/20 0.54
CHRM4 P08173 1/20 0.54
ABCB1 P08183 1/20 0.54
CYP3A4 P08684 1/20 0.54
HTR1A P08908 1/20 0.54
CHRM5 P08912 1/20 0.54
ADRA2A P08913 1/20 0.54
CYP2D6 P10635 1/20 0.54
CHRM1 P11229 1/20 0.54

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
SCHEMBL19236299 0.82 DRD2 (0.62) DRD2ADRA1ADRD4DRD3MEN1
SCHEMBL10287607 0.81 OPRM1 (0.63) DRD2ADRA1ACCR1DRD3HTR1A
SCHEMBL14307260 0.79 CCR3 (0.69) DRD2ADRA1ACCR1DRD3HTR1A
SCHEMBL11632873 0.79 ALDH1A1 (0.56) DRD2DRD4MEN1CYP1A2CYP3A4
SCHEMBL20254427 0.78 DRD2 (0.74) DRD2ADRA1ADRD4DRD3MEN1
SCHEMBL7463924 0.78 CCR3 (0.71) CCR1
SCHEMBL11938907 0.77 DRD2 (0.65) DRD2ADRA1ACCR1DRD3HTR1A
SCHEMBL7467269 0.77 CCR3 (0.68) CCR1
SCHEMBL10287975 0.76 CCR3 (0.65) DRD2ADRA1ACCR1DRD3HTR1A
SCHEMBL3278197 0.75 APP (0.53) CCR1MEN1OPRM1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020151553-A1 Chemokine receptor antagonists and methods of use therefor MILLENNIUM PHARMACEUTICALS, INC. (US) 2002-10-17 US disclosed
US-6433165-B1 ANTIINFLAMMATORY AGENTS MILLENNIUM PHARMACEUTICALS, INC. 2002-08-13 US disclosed
EP-1204640-A2 CHEMOKINE RECEPTOR ANTAGONISTS AND METHODS OF USE THEREFOR Millennium Pharmaceuticals, Inc. (US) 2002-05-15 EP disclosed
US-6323206-B1 ANTIINFLAMMATORY AGENTS AND VIRICIDES FOR AIDS WITH CYTOKINESAND CHEMOKINES MILLENNIUM PHARMACEUTICALS, INC. 2001-11-27 US disclosed
WO-2001009094-A2 CHEMOKINE RECEPTOR ANTAGONISTS AND METHODS OF USE THEREFOR MILLENNIUM PHARMACEUTICALS, INC. (US) 2001-02-08 WO disclosed
EP-1049675-A1 CHEMOKINE RECEPTOR ANTAGONISTS AND METHODS OF USE THEREFOR Millennium Pharmaceuticals, Inc. (US) 2000-11-08 EP disclosed
EP-1047675-A1 CHEMOKINE RECEPTOR ANTAGONISTS AND METHODS OF USE THEREFOR Millennium Pharmaceuticals, Inc. (US) 2000-11-02 EP disclosed
WO-1999037617-A1 CHEMOKINE RECEPTOR ANTAGONISTS AND METHODS OF USE THEREFOR MILLENNIUM PHARMACEUTICALS, INC. (US) 1999-07-29 WO disclosed
WO-1999037619-A1 CHEMOKINE RECEPTOR ANTAGONISTS AND METHODS OF USE THEREFOR MILLENNIUM PHARMACEUTICALS, INC. (US) 1999-07-29 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-20020151553-A1 Chemokine receptor antagonists and methods of use therefor CCR1, CCR2, CCR5 DRD2 2098/4885ADRA1A 445/4885CCR1 1/4885

“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.