SCHEMBL3341341

SCHEMBL3341341

COc1ccc(Cl)cc1-c1ccc(C(=O)NCCC(C)C)c(F)c1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
HTT P42858 1/20 0.49
DNMT3A Q9Y6K1 1/20 0.49
GCG P01275 3/20 0.48
ALDH1A1 P00352 2/20 0.47
HDAC1 Q13547 2/20 0.46
HDAC6 Q9UBN7 2/20 0.46
NLRP3 Q96P20 3/20 0.45
NPC1 O15118 1/20 0.45
CYP3A4 P08684 1/20 0.45
HPGD P15428 1/20 0.44
PKM P14618 1/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43

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
SCHEMBL2099245 0.88 GCG (0.48) LMNAHTTDNMT3AGCGALDH1A1
SCHEMBL2104046 0.86 GCG (0.51) LMNAHTTDNMT3AGCGNPC1
SCHEMBL3343607 0.86 LMNA (0.70) LMNAHTTDNMT3AGCGALDH1A1
SCHEMBL2100014 0.82 ALDH1A1 (0.50) LMNAHTTALDH1A1NPC1HPGD
SCHEMBL2099967 0.81 ALDH1A1 (0.58) LMNAHTTALDH1A1HPGD
SCHEMBL2102473 0.79 GCG (0.48) LMNAGCGALDH1A1
SCHEMBL3341362 0.78 KMT2A (0.52) LMNAHTTDNMT3AGCGALDH1A1
SCHEMBL3340724 0.78 NAAA (0.51) LMNAALDH1A1NLRP3CYP3A4HPGD
SCHEMBL2099314 0.78 TSHR (0.46) LMNAGCGALDH1A1CYP3A4
SCHEMBL1154060 0.76 DNMT3A (0.68) DNMT3AHDAC1HDAC6NLRP3

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-8722741-B2 Biphenyloxyacetic acid derivatives for the treatment of respiratory disease ASTRAZENECA AB (SE) 2014-05-13 US disclosed
EP-1784388-B3 BIPHENYLOXYACETIC ACID DERIVATIVES FOR THE TREATMENT OF RESPIRATORY DISEASE ASTRAZENECA AB (SE) 2012-09-05 EP disclosed
US-20120178732-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease LUKER TIMOTHY JON (GB) 2012-07-12 US disclosed
US-20100160285-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease ASTRAZENECA AB (SE) 2010-06-24 US disclosed
US-7737135-B2 Biphenyloxyacetic acid derivatives for the treatment of respiratory disease ASTRAZENECA AB (SE) 2010-06-15 US disclosed
EP-1784388-B1 BIPHENYLOXYACETIC ACID DERIVATIVES FOR THE TREATMENT OF RESPIRATORY DISEASE ASTRAZENECA AB (SE) 2009-11-04 EP disclosed
US-20080132480-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease ASTRAZENECA AB (SE) 2008-06-05 US 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 (3 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-20120178732-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease CYP26A1, CYP1A1, GPBAR1 LMNA 2229/4885HTT 1593/4885DNMT3A 4771/4885
US-20100160285-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease CYP26A1, CYP1A1, GPBAR1 LMNA 2229/4885HTT 1593/4885DNMT3A 4771/4885
US-20080132480-A1 Biphenyloxyacetic Acid Derivatives for the Treatment of Respiratory Disease CYP26A1, CYP1A1, GPBAR1 LMNA 2229/4885HTT 1593/4885DNMT3A 4771/4885

“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.