SCHEMBL6503460

SCHEMBL6503460

CCN(CCCNC(=O)c1ccc(F)cc1)Cc1cccc(Oc2ccccc2OC)c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.52
ACKR3 P25106 3/20 0.52
TMEM97 Q5BJF2 2/20 0.52
APP P05067 5/20 0.51
OPRM1 P35372 2/20 0.49
PRMT5 O14744 1/20 0.47
WDR77 Q9BQA1 1/20 0.47
DRD2 P14416 1/20 0.47
DRD1 P21728 1/20 0.47
DRD4 P21917 1/20 0.47
DRD5 P21918 1/20 0.47
HTR2C P28335 1/20 0.47
DRD3 P35462 1/20 0.47
LPAR1 Q92633 1/20 0.45
LPAR5 Q9H1C0 1/20 0.45
OPRK1 P41145 1/20 0.45

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
SCHEMBL6499869 0.91 ACKR3 (0.58) SIGMAR1ACKR3TMEM97APP
SCHEMBL6499418 0.88 APP (0.46) ACKR3APP
SCHEMBL6498560 0.85 MEN1 (0.62) SIGMAR1ACKR3TMEM97OPRM1OPRK1
SCHEMBL6500080 0.84 CCR8 (0.50) APP
SCHEMBL6498806 0.83 ACHE (0.50) APP
SCHEMBL6508928 0.83 GAA (0.62) APP
SCHEMBL6500361 0.83 APP (0.47) APPDRD2
SCHEMBL6505243 0.83 ACHE (0.51) APP
SCHEMBL6503409 0.82 MCHR1 (0.47) SIGMAR1APPDRD2DRD3
SCHEMBL6496812 0.82 BCHE (0.55) SIGMAR1TMEM97APPOPRM1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor MILLENNIUM PHARMACEUTICALS, INC. 2005-06-30 US disclosed
WO-2003037271-A2 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE THEREFOR MILLENNIUM PHARMACEUTICALS,INC. (US) 2003-05-08 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-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor CCR8, CCL11, CCR5 SIGMAR1 525/4885ACKR3 17/4885TMEM97 1169/4885

“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.