SCHEMBL5046412

SCHEMBL5046412

COC(=O)c1ccccc1S(=O)(=O)N(CCCc1cccc(Cl)c1)CCCc1ccc(C(=O)O)s1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
TSHR P16473 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
APEX1 P27695 1/20 0.39
TAS2R14 Q9NYV8 2/20 0.37
LMNA P02545 2/20 0.36
PLAAT3 P53816 1/20 0.36
PLAAT5 Q96KN8 1/20 0.36
PLAAT2 Q9NWW9 1/20 0.36
PLAAT4 Q9UL19 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PKM P14618 1/20 0.36
PLA2G2A P14555 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CA1 P00915 1/20 0.35

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
SCHEMBL5046539 0.87 HTT (0.45) ALDH1A1POLBTAS2R14LMNAPLAAT3
SCHEMBL5047973 0.85 LMNA (0.46) POLBMAPTTAS2R14LMNAPLAAT3
SCHEMBL5043363 0.85 TAS2R14 (0.39) KDM4EHSD17B10POLBTAS2R14LMNA
SCHEMBL5046905 0.84 TAS2R14 (0.50) POLBTAS2R14PLAAT3PLAAT5PLAAT2
SCHEMBL5046371 0.83 TAS2R14 (0.43) TSHRALDH1A1MAPK1MAPTTAS2R14
SCHEMBL5048001 0.82 TAS2R14 (0.57) ALDH1A1MAPTTAS2R14BMP1
SCHEMBL5046370 0.82 TDP1 (0.38) ALDH1A1MAPTTAS2R14LMNATDP1
SCHEMBL2769588 0.82 TAS2R14 (0.39) TAS2R14PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL7227270 0.81 MRGPRX4 (0.44) KDM4ETSHRALDH1A1POLBMAPT
SCHEMBL5726407 0.81 TAS2R14 (0.39) TAS2R14PLAAT3PLAAT5PLAAT2PLAAT4

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 KDM4E 3785/4885TSHR 60/4885ALDH1A1 3293/4885
US-20030078261-A1 Prostaglandin agonists PTGER1, PTGER4, PTGIR KDM4E 3926/4885TSHR 854/4885ALDH1A1 1987/4885

“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.