SCHEMBL1370296

SCHEMBL1370296

CC1(O)c2ccc(Br)cc2S(=O)(=O)C1(C)C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.39
CA2 P00918 4/20 0.37
CA1 P00915 3/20 0.37
CA9 Q16790 3/20 0.37
CA4 P22748 2/20 0.37
CA7 P43166 2/20 0.37
CA12 O43570 2/20 0.37
VEGFA P15692 2/20 0.32
ERN1 O75460 1/20 0.32
PIM1 P11309 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 2/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL12145523 0.76 PTGDR2 (0.37) PTGDR2VEGFAMEN1KMT2ALMNA
SCHEMBL1370145 0.76 PTGDR2 (0.41) PTGDR2CA2CA1CA9CA4
SCHEMBL12145528 0.76 PTGDR2 (0.36) PTGDR2CA2CA1CA9CA12
SCHEMBL3742800 0.69 CA1 (0.45) CA2CA1CA9CA4CA7
SCHEMBL24697302 0.68 CA2 (0.44) CA2CA1CA9CA4CA7
SCHEMBL31568291 0.68 CA2 (0.44) CA2CA1CA9CA4CA7
SCHEMBL14099590 0.66 PDK2 (0.39) CA2CA1CA9CA4CA7
SCHEMBL1371402 0.66 PTGDR2 (0.41) PTGDR2CA2CA1CA9CA4
SCHEMBL19325059 0.66 KMT2A (0.36) CA2CA1CA9CA4CA7
SCHEMBL1370587 0.66 CA1 (0.43) PTGDR2CA2CA1CA9CA4

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 7 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-8273769-B2 Phenoxy acetic acid derivatives MERCK SERONO SA (CH) 2012-09-25 US disclosed
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
US-20110288066-A1 PHENOXY ACETIC ACID DERIVATIVES MERCK SERONO S.A. (CH) 2011-11-24 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 51/4885CA2 804/4885CA1 3256/4885

“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.