SCHEMBL5046371

SCHEMBL5046371

COc1ccc(OC)c(S(=O)(=O)N(CCCc2cccc(Cl)c2)CCCc2ccc(C(=O)O)s2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 1/20 0.43
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ALDH1A1 P00352 7/20 0.42
KMT2A Q03164 2/20 0.42
TSHR P16473 2/20 0.42
MEN1 O00255 1/20 0.42
PI4KB Q9UBF8 1/20 0.42
LPAR1 Q92633 1/20 0.39
LPAR2 Q9HBW0 1/20 0.39
PTGER4 P35408 1/20 0.39
PTGER2 P43116 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39

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
SCHEMBL5048001 0.88 TAS2R14 (0.57) TAS2R14MAPTALDH1A1
SCHEMBL5046412 0.83 KDM4E (0.40) TAS2R14LMNAMAPTMAPK1ALDH1A1
SCHEMBL5046539 0.82 HTT (0.45) TAS2R14LMNAALDH1A1KMT2AMEN1
SCHEMBL5046905 0.81 TAS2R14 (0.50) TAS2R14KMT2AMEN1
SCHEMBL5046370 0.81 TDP1 (0.38) TAS2R14LMNAMAPTNPSR1ALDH1A1
SCHEMBL2769588 0.81 TAS2R14 (0.39) TAS2R14KMT2AMEN1
SCHEMBL5047973 0.81 LMNA (0.46) TAS2R14LMNAMAPTKMT2AMEN1
SCHEMBL5726407 0.80 TAS2R14 (0.39) TAS2R14KMT2AMEN1
SCHEMBL5726420 0.80 TAS2R14 (0.41) TAS2R14KMT2AMEN1
SCHEMBL5727230 0.80 TAS2R14 (0.39) TAS2R14ALDH1A1SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7442702-B2 Treatment of bone disorders; carboxy derivatives PFIZER INC. (US) 2008-10-28 US disclosed
EP-1021410-B1 PROSTAGLANDIN AGONISTS AND THEIR USE TO TREAT BONE DISORDERS PFIZER (US) 2006-12-27 EP disclosed
US-20050203086-A1 Methods of treatment using an EP2 selective receptor agonist PFIZER INC. 2005-09-15 US disclosed
US-20030078261-A1 Prostaglandin agonists CAMERON KIMBERLY O (US) 2003-04-24 US disclosed
US-6498172-B1 (3-(((4-TERT-BUTYL-BENZYL)-(PYRIDINE-3-SULFONYL)-AMINO)-METHYL) -PHENOXY)-ACETIC ACID OR SALT; TREATING SUCH AS OSTEOPOROSIS PFIZER INC. 2002-12-24 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 (2 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-20050203086-A1 Methods of treatment using an EP2 selective receptor agonist PTGER2, PTGES2, PTGFR TAS2R14 518/4885LMNA 1786/4885MAPT 3918/4885
US-20030078261-A1 Prostaglandin agonists PTGER1, PTGER4, PTGIR TAS2R14 4081/4885LMNA 1317/4885MAPT 4645/4885

“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.