SCHEMBL4444967

SCHEMBL4444967

Cc1ccc(S(=O)(=O)N(CCc2ccc(-n3nc(C)c(-c4ccc(F)cc4)c3C)cc2)C(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.53
TAS2R14 Q9NYV8 2/20 0.46
TP53 P04637 1/20 0.41
CYP2D6 P10635 1/20 0.40
CNR2 P34972 2/20 0.39
CNR1 P21554 1/20 0.39
AR P10275 1/20 0.39
LMNA P02545 1/20 0.39
NPY5R Q15761 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL4443171 0.92 CNR2 (0.45) CYP1A2TAS2R14TP53CNR2CNR1
SCHEMBL6099551 0.88 HTT (0.47) CYP1A2TP53CNR2LMNA
SCHEMBL6097443 0.82 CNR2 (0.42) TAS2R14TP53CNR2CNR1AR
SCHEMBL6098396 0.81 CNR2 (0.43) TAS2R14CNR2CNR1
SCHEMBL6096840 0.80 CNR2 (0.48) TAS2R14TP53CNR2CNR1
SCHEMBL6830539 0.80 LMNA (0.38) CYP1A2TAS2R14TP53CNR2CNR1
SCHEMBL6097754 0.80 CNR2 (0.49) TAS2R14CNR2CNR1AR
SCHEMBL6097834 0.79 CNR2 (0.49) TAS2R14CNR2CNR1
SCHEMBL6096752 0.78 CA1 (0.54) CYP1A2TP53
SCHEMBL6098579 0.77 POLB (0.46) CYP1A2TP53LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005102389-A9 COMBINATIONS COMPRISING ALPHA-2-DELTA LIGANDS AND EP4 RECEPTOR ANTAGONISTS PFIZER PROD INC (US) 2009-04-30 WO claimed
US-20090036495-A1 Combinations Comprising Alpha-2-Delta Ligands and Ep4 Receptor Antagonists PFIZER, INC. 2009-02-05 US claimed
US-20090036495-A1 Combinations Comprising Alpha-2-Delta Ligands and Ep4 Receptor Antagonists PFIZER, INC. 2009-02-05 US disclosed
EP-1740211-A2 COMBINATIONS COMPRISING ALPHA-2-DELTA LIGANDS AND EP4 RECEPTOR ANTAGONISTS Pfizer Products Incorporated (US) 2007-01-10 EP disclosed
WO-2005102389-A2 COMBINATIONS COMPRISING ALPHA-2-DELTA LIGANDS AND EP4 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2005-11-03 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-20090036495-A1 Combinations Comprising Alpha-2-Delta Ligands and Ep4 Receptor Antagonists PTGER4, PTGER2, OPRL1 CYP1A2 1834/4885TAS2R14 875/4885TP53 4735/4885

“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.