SCHEMBL6216294

SCHEMBL6216294

COC(=O)CCc1ccccc1OCC(O)CN1CCC(Oc2ccc(Cl)cc2)C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.47
HRH1 P35367 1/20 0.47
CCR3 P51677 1/20 0.47
DRD4 P21917 6/20 0.47
DRD2 P14416 4/20 0.47
DRD3 P35462 3/20 0.46
HSD17B10 Q99714 1/20 0.44
CYP2D6 P10635 3/20 0.44
MAPT P10636 1/20 0.42
ABCB1 P08183 2/20 0.41
ABCB11 O95342 1/20 0.41
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.40
NPY1R P25929 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
SCHEMBL6214454 0.95 DRD4 (0.53) CCR1HRH1CCR3DRD4DRD2
SCHEMBL6212093 0.92 DRD2 (0.47) CCR1HRH1CCR3DRD4DRD2
SCHEMBL6214791 0.91 HRH1 (0.58) CCR1HRH1CCR3
SCHEMBL6214507 0.89 CCR3 (0.45) CCR1HRH1CCR3DRD4DRD2
SCHEMBL6211979 0.89 DRD2 (0.46) CCR1HRH1CCR3DRD4DRD2
SCHEMBL28750368 0.87 DRD4 (0.49) CCR1HRH1CCR3DRD4DRD2
SCHEMBL6215243 0.87 DRD2 (0.53) CCR1HRH1CCR3DRD4DRD2
SCHEMBL7511865 0.86 DRD4 (0.49) CCR1HRH1CCR3DRD4DRD2
SCHEMBL6214828 0.86 HRH1 (0.64) CCR1HRH1CCR3DRD4DRD2
SCHEMBL6214184 0.85 HSD17B10 (0.52) DRD4HSD17B10CYP2D6ABCB1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1263724-B1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2005-05-18 EP claimed
US-20030149047-A1 Novel compounds ASTRAZENCA AB (SE) 2003-08-07 US claimed
EP-1263724-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2002-12-11 EP claimed
WO-2001062728-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2001-08-30 WO claimed
US-6951874-B2 Compounds ASTRAZENECA AB (SE) 2005-10-04 US disclosed
US-6943188-B2 Hydroxyalkyl compounds ASTRAZENECA AB (SE) 2005-09-13 US disclosed
US-6927222-B2 1,3,4,5-tetrahydro-pyrido(4,3-b)indole-2-yl derivative useful for treating rheumatoid arthritis, chronic obstructive pulmonary disease, asthma and multple sclerosis ASTRAZENECA AB (SE) 2005-08-09 US disclosed
EP-1263724-B1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2005-05-18 EP disclosed
CN-1458281-A Coronary virus RNA interference preparation for severe acute respiratory syndrome pathogen HUANQIU ZHONGJIA BIOLOG SCIENC (CN) 2003-11-26 CN disclosed
US-20030158225-A1 Novel compounds ASTRAZENECA AB (SE) 2003-08-21 US disclosed
US-20030149047-A1 Novel compounds ASTRAZENCA AB (SE) 2003-08-07 US disclosed
US-20030144267-A1 Novel compounds ASTRAZENECA AB (SE) 2003-07-31 US disclosed
CN-1426394-A Novel compounds ASTRAZENECA AB (SE) 2003-06-25 CN disclosed
CN-1426412-A Novel compounds ASTRAZENECA AB (SE) 2003-06-25 CN disclosed
EP-1263760-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2002-12-11 EP disclosed
EP-1263725-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2002-12-11 EP disclosed
EP-1263724-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2002-12-11 EP disclosed
WO-2001062757-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2001-08-30 WO disclosed
WO-2001062729-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2001-08-30 WO disclosed
WO-2001062728-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2001-08-30 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 (3 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-20030158225-A1 Novel compounds UGT2B7, RPS4Y1, RPS4X CCR1 867/4885HRH1 657/4885CCR3 1450/4885
US-20030149047-A1 Novel compounds RPS4Y1, RPS4X, RPS6 CCR1 747/4885HRH1 545/4885CCR3 1515/4885
US-20030144267-A1 Novel compounds RPS4X, RPS4Y1, UGT2B7 CCR1 1236/4885HRH1 673/4885CCR3 1437/4885

“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.