SCHEMBL6300904

SCHEMBL6300904

O=C(NCCN1CCC(CCOc2ccc(F)cc2)CC1)Nc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 4/20 0.62
CCR2 P41597 1/20 0.54
CHRM4 P08173 1/20 0.54
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
POLB P06746 1/20 0.54
LMNA P02545 1/20 0.53
HTR2A P28223 1/20 0.52
TP53 P04637 1/20 0.52
MAPT P10636 1/20 0.52
NPSR1 Q6W5P4 1/20 0.51

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
SCHEMBL5564143 0.81 NAMPT (0.51) CHRM4
SCHEMBL5567916 0.78 CHRM4 (0.44) CHRM4HTR2A
SCHEMBL6300800 0.78 LMNA (0.47) CCR3CHRM4KMT2AMEN1LMNA
SCHEMBL7302889 0.78 LMNA (0.69) CCR3KMT2AMEN1POLBLMNA
SCHEMBL3946388 0.78 CHRM4 (0.55) CHRM4
Oxalic Acid SCHEMBL7318217 0.76 SLC6A2 (0.53) KMT2AMEN1HTR2A
Oxalic Acid SCHEMBL7320390 0.76 SLC6A4 (0.64)
Hydrochloric Acid SCHEMBL7321403 0.75 KCNH2 (0.73) HTR2A
SCHEMBL6295115 0.74 CHRM4 (0.40) CCR3CHRM4
SCHEMBL5563921 0.74 CHRNA7 (0.42) CCR3CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6908922-B2 Anticholesterol agents; cardiovascular disorders LES LABORATOIRES SERVIER (FR) 2005-06-21 US disclosed
US-6903103-B2 Linear cyclic ureas LES LABORATORIES SERVIER (FR) 2005-06-07 US disclosed
US-6780868-B2 TREATMENT OF MYOCARDIAL OR PERIPHERAL ISCHAEMIA, CARDIAC INSUFFICIENCY OR PULMONARY ARTERIAL HYPERTENSION LES LABORATOIRES SERVIER (FR) 2004-08-24 US disclosed
US-20030229100-A1 New linear cyclic ureas PEGLION JEAN-LOUIS (FR) 2003-12-11 US disclosed
US-20030225105-A1 New linear cyclic ureas PEGLION JEAN-LOUIS (FR) 2003-12-04 US disclosed
US-20030191132-A1 New linear cyclic ureas PEGLION JEAN-LOUIS (FR) 2003-10-09 US disclosed
US-6566364-B2 Isomers, hydrates, solvates and addition salts in treatment of endothelial dysfunction disease such as atherosclerosis, dyslipidaemia; antidiabetic agents; heart transplantation; inhibition of nitrogen monoxide synthase and oxidative stress LES LABORATOIRES SERVIER (FR) 2003-05-20 US disclosed
US-20010009911-A1 New linear or cyclic ureas LES LABORATOIRES SERVIER (FR) 2001-07-26 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 (4 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-20010009911-A1 New linear or cyclic ureas GUCY1B1, UACA, LIPG CCR3 671/4885CCR2 270/4885CHRM4 929/4885
US-20030191132-A1 New linear cyclic ureas GUCY1B1, UACA, GUCY1A1 CCR3 975/4885CCR2 269/4885CHRM4 1108/4885
US-20030229100-A1 New linear cyclic ureas GUCY1B1, UACA, GUCY1A1 CCR3 975/4885CCR2 269/4885CHRM4 1108/4885
US-20030225105-A1 New linear cyclic ureas GUCY1B1, UACA, GUCY1A1 CCR3 975/4885CCR2 269/4885CHRM4 1108/4885

“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.