SCHEMBL1369916

SCHEMBL1369916

COC1c2ccc(Br)cc2S(O)(O)C1(C)C

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.32
ALDH1A1 P00352 2/20 0.31
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL1369918 0.81 PTGDR2 (0.43) LMNAMAPK1PTGDR2ALDH1A1POLB
SCHEMBL1371402 0.65 PTGDR2 (0.41) LMNAMAPK1PTGDR2ALDH1A1POLB
SCHEMBL1370144 0.64 PTGDR2 (0.31) PTGDR2
SCHEMBL12145508 0.61 PTGDR2 (0.42) PTGDR2ALDH1A1CA1CA2
SCHEMBL16126803 0.58 CA1 (0.42) LMNAMAPK1PTGDR2ALDH1A1POLB
SCHEMBL19378180 0.58 NPC1 (0.36) LMNAALDH1A1POLBTSHRKMT2A
SCHEMBL19378182 0.58 NPC1 (0.36) LMNAALDH1A1POLBTSHRKMT2A
SCHEMBL22203929 0.57 NQO2 (0.40) LMNAMAPK1ALDH1A1POLBTSHR
SCHEMBL19125887 0.56 KDM1A (0.46) POLBMEN1KMT2A
SCHEMBL2509450 0.55 S100A4 (0.37) LMNAMAPK1ALDH1A1POLBCA1

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-8273769-B2 Phenoxy acetic acid derivatives MERCK SERONO SA (CH) 2012-09-25 US disclosed
EP-2396295-A1 PHENOXY ACETIC ACID DERIVATIVES Merck Serono S.A. (CH) 2011-12-21 EP 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 LMNA 4243/4885MAPK1 843/4885PTGDR2 51/4885

“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.