SCHEMBL7119653

SCHEMBL7119653

CCOC(=O)c1ccc(CBr)cc1C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.68
CYP4A11 Q02928 1/20 0.68
TSHR P16473 3/20 0.51
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47
CA14 Q9ULX7 2/20 0.47
ALDH1A1 P00352 5/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HSD17B10 Q99714 2/20 0.43
GAA P10253 2/20 0.43
HPGD P15428 2/20 0.43
MAPT P10636 1/20 0.43
ALOX15 P16050 1/20 0.43
RAB9A P51151 1/20 0.43
CFD P00746 1/20 0.42
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41

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
SCHEMBL28751219 0.89 TSHR (0.56) CYP4F2CYP4A11TSHRCA12CA1
SCHEMBL6139480 0.86 CA12 (0.53) CYP4F2CYP4A11TSHRCA12CA1
SCHEMBL4834423 0.84 CYP4F2 (0.72) CYP4F2CYP4A11TSHRCA12CA1
SCHEMBL7410301 0.84 CYP4F2 (0.68) CYP4F2CYP4A11TSHRCA12CA1
SCHEMBL10424450 0.84 ALDH1A1 (0.49) CYP4F2CYP4A11TSHRCA12CA1
SCHEMBL6289032 0.83 CYP4F2 (0.66) CYP4F2CYP4A11TSHRCA12CA1
SCHEMBL1702411 0.83 CYP4F2 (0.66) CYP4F2CYP4A11TSHRCA12CA1
SCHEMBL6971203 0.81 CYP4F2 (0.78) CYP4F2CYP4A11TSHRCA12CA1
SCHEMBL22098189 0.81 CYP4F2 (1.00) CYP4F2CYP4A11TSHRCA12CA1
SCHEMBL4918846 0.81 CYP4F2 (0.68) CYP4F2CYP4A11TSHRCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030186944-A1 Such as 4-(2-(3-dimethylaminobenzoylamino)phenoxy)phthalic acid for treatment/prevention of diabetes; for inhibiting liver glycogen phosphorylase; dietetics KRISTIANSEN MARIT (DK) 2003-10-02 US disclosed
US-6590118-B1 Used in treatment of and/or prevention of diabetes, especially non-insulin dependent diabetes (Type 2 diabetes) NOVO NORDISK A/S (DK) 2003-07-08 US disclosed
EP-1220832-A1 NOVEL AROMATIC COMPOUNDS NOVO NORDISK A/S (DK) 2002-07-10 EP disclosed
WO-2001023347-A1 NOVEL AROMATIC COMPOUNDS NOVO NORDISK A/S (DK) 2001-04-05 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-20030186944-A1 Such as 4-(2-(3-dimethylaminobenzoylamino)phenoxy)phthalic acid for treatment/prevention of diabetes; for inhibiting liver glycogen phosphorylase; dietetics PYGL, GYS2, PYGM CYP4F2 309/4885CYP4A11 301/4885TSHR 3696/4885

“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.