SCHEMBL5726591

SCHEMBL5726591

CCCCS(=O)(=O)N(CCCc1cccc(Cl)c1)CCCc1ccc(C(=O)OC(C)(C)C)s1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
RIPK1 Q13546 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PTGS1 P23219 1/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
CNR2 P34972 1/20 0.32
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
GRM5 P41594 1/20 0.32

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
SCHEMBL5725632 0.93 KDM4E (0.35) RIPK1KDM4EHSP90AA1HSP90AB1LMNA
SCHEMBL5726508 0.87 ALDH1A1 (0.37) BMP1ALDH1A1HPGDCNR2TAAR1
SCHEMBL5726349 0.85 MRGPRX4 (0.41) BMP1HPGDKDM4EMEN1LMNA
SCHEMBL5725959 0.84 MRGPRX4 (0.43) ALDH1A1HPGDKDM4EHSP90AA1LMNA
SCHEMBL5043429 0.84 HTT (0.39) KDM4EHSP90AA1HSP90AB1TAAR1
SCHEMBL5725567 0.82 TAS2R14 (0.37) ALDH1A1HPGDTAAR1
SCHEMBL5043024 0.82 KDM4E (0.37) ALDH1A1HPGDRIPK1KDM4EMEN1
SCHEMBL5727081 0.82 GRM5 (0.38) ALDH1A1HPGDRIPK1KDM4EHSP90AA1
SCHEMBL5727230 0.81 TAS2R14 (0.39) ALDH1A1HPGDTAAR1
SCHEMBL5043004 0.80 KDM4E (0.41) ALDH1A1HPGDKDM4EMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0946501-B1 PREVENTION OF LOSS AND RESTORATION OF BONE MASS BY CERTAIN PROSTAGLANDIN AGONISTS PFIZER (US) 2006-05-31 EP disclosed
US-6998423-B2 Prevention of loss and restoration of bone mass by certain prostaglandin agonists PFIZER INC. (US) 2006-02-14 US disclosed
US-20040176461-A1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists PFIZER INC 2004-09-09 US disclosed
US-6649657-B2 Administering amide to treat osteoporosis PFIZER INC. 2003-11-18 US disclosed
US-20030105092-A1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists CAMERON KIMBERLEY Q (US) 2003-06-05 US disclosed
US-6492412-B2 ADMINISTERING TO A MAMMAL A THERAPEUTICALLY EFFECTIVE AMOUNT OF A COMPOUND OF SULFONAMIDE OR ALKANOY OR AMIDE DERIVATIVE CONTAINING HETERO OR AROMATIC RINGS TO TREAT OSTEOPOROSIS, OSTEOTOMY, CHILDHOOD IDIOPATHIC BOEN LOSS ETC. PFIZER, INC. 2002-12-10 US disclosed
US-20020016368-A1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists CAMERON KIMBERLY O (US) 2002-02-07 US disclosed
US-6344485-B1 Method for treating glaucoma PFIZER INC. 2002-02-05 US disclosed
US-6288120-B1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists PFIZER INC. 2001-09-11 US disclosed
EP-1000619-A2 Method for treating glaucoma Pfizer Products Inc. (US) 2000-05-17 EP 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-20040176461-A1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists HPGDS, PTGIR, PTGER1 BMP1 123/4885ALDH1A1 2216/4885HPGD 20/4885
US-20020016368-A1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists HPGDS, PTGIR, PTGER1 BMP1 123/4885ALDH1A1 2216/4885HPGD 20/4885
US-20030105092-A1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists HPGDS, PTGIR, PTGER1 BMP1 123/4885ALDH1A1 2216/4885HPGD 20/4885

“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.