SCHEMBL12147299

SCHEMBL12147299

CC(C)Cc1ccncc1-c1cc(Cl)ccc1OCC(=O)O

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 14/20 0.69
MAPT P10636 1/20 0.47
TDP1 Q9NUW8 2/20 0.47
TSHR P16473 1/20 0.46
PTGER1 P34995 2/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44

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
SCHEMBL12147122 0.86 PTGDR2 (0.53) PTGDR2MAPTTDP1PTGER1CYP3A4
SCHEMBL12147184 0.85 PTGDR2 (0.69) PTGDR2MAPTTDP1TSHRPTGER1
SCHEMBL12147300 0.82 PTGDR2 (0.66) PTGDR2MAPTTDP1TSHRPTGER1
SCHEMBL1369065 0.82 PTGDR2 (1.00) PTGDR2CYP2C9
SCHEMBL12147011 0.82 PTGDR2 (0.71) PTGDR2MAPTTDP1TSHRPTGER1
SCHEMBL12147488 0.76 PTGDR2 (0.76) PTGDR2MAPTTDP1TSHR
SCHEMBL12147371 0.75 PTGDR2 (0.75) PTGDR2MAPTTDP1TSHRPTGER1
SCHEMBL12147560 0.72 PTGDR2 (0.52) PTGDR2MAPTTDP1PTGER1CYP3A4
SCHEMBL1753770 0.72 PTGDR2 (0.70) PTGDR2MAPTTDP1TSHR
SCHEMBL12147110 0.72 PTGDR2 (0.65) PTGDR2MAPTTDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8273769-B2 Phenoxy acetic acid derivatives MERCK SERONO SA (CH) 2012-09-25 US disclosed
US-20110288066-A1 PHENOXY ACETIC ACID DERIVATIVES MERCK SERONO S.A. (CH) 2011-11-24 US disclosed
WO-2010092043-A1 PHENOXY ACETIC ACID DERIVATIVES MERCK SERONO S.A. (CH) 2010-08-19 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-20110288066-A1 PHENOXY ACETIC ACID DERIVATIVES HRH2, HRH1, HRH3 PTGDR2 51/4885MAPT 1772/4885TDP1 4632/4885

“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.