SCHEMBL4947759

SCHEMBL4947759

O=C(O)COc1cccc(CN(Cc2ccc(-c3ccccn3)cc2)S(=O)(=O)c2cccnc2)c1

nearest known ligand 0.75

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA12 O43570 11/20 0.75
CA1 P00915 11/20 0.75
CA2 P00918 11/20 0.75
CA4 P22748 11/20 0.75
CA9 Q16790 11/20 0.75
PTGER2 P43116 8/20 0.72
PTPN1 P18031 1/20 0.53

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
Hydrochloric Acid SCHEMBL6058754 0.99 CA12 (0.73) CA12CA1CA2CA4CA9
SCHEMBL5049391 0.93 CA12 (0.70) CA12CA1CA2CA4CA9
SCHEMBL13399091 0.92 PTGER2 (0.64) CA12CA1CA2CA4CA9
SCHEMBL5049385 0.92 CA12 (0.69) CA12CA1CA2CA4CA9
Hydrochloric Acid SCHEMBL5050314 0.91 CA12 (0.75) CA12CA1CA2CA4CA9
Hydrochloric Acid SCHEMBL5047950 0.89 CA12 (0.77) CA12CA1CA2CA4CA9
SCHEMBL4943989 0.89 CA12 (0.80) CA12CA1CA2CA4CA9
SCHEMBL4948341 0.89 CA12 (0.80) CA12CA1CA2CA4CA9
SCHEMBL13399135 0.88 PTGER2 (0.71) CA12CA1CA2CA4CA9
Hydrochloric Acid SCHEMBL6059996 0.88 CA12 (0.78) CA12CA1CA2CA4CA9

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1021410-B1 PROSTAGLANDIN AGONISTS AND THEIR USE TO TREAT BONE DISORDERS PFIZER (US) 2006-12-27 EP claimed
EP-1448182-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR ADMINISTERING EP 2 RECEPTOR SELECTIVE AGONISTS Pfizer Products Inc. (US) 2004-08-25 EP claimed
US-20030166631-A1 Pharmaceutical compositions and methods for administering EP2 receptor selective agonists DUMONT FRANCIS (US) 2003-09-04 US claimed
WO-2003045371-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR ADMINISTERING EP2 RECEPTOR SELECTIVE AGONISTS PFIZER PRODUCTS INC. (US) 2003-06-05 WO claimed
US-20030078261-A1 Prostaglandin agonists CAMERON KIMBERLY O (US) 2003-04-24 US claimed
EP-1108426-A2 Use of prostaglandin agonists to treat erectile dysfunction or impotence Pfizer Products Inc. (US) 2001-06-20 EP claimed
US-7442702-B2 Treatment of bone disorders; carboxy derivatives PFIZER INC. (US) 2008-10-28 US disclosed
EP-1697356-B1 PYRIDO[2,3-D]PYRIMIDINE-2,4-DIAMINES AS PDE 2 INHIBITORS PFIZER PROD INC (US) 2008-02-27 EP disclosed
US-20070135457-A1 Pyrido[2,3-d]pyrimidine-2,4-diamines as pde2 inhibitors PFIZER INC. 2007-06-14 US disclosed
EP-1021410-B1 PROSTAGLANDIN AGONISTS AND THEIR USE TO TREAT BONE DISORDERS PFIZER (US) 2006-12-27 EP disclosed
EP-1697356-A1 PYRIDO[2,3-D]PYRIMIDINE-2,4-DIAMINES AS PDE 2 INHIBITORS Pfizer Products Incorporated (US) 2006-09-06 EP disclosed
EP-1601351-A1 USE OF EP2 SELECTIVE RECEPTOR AGONISTS IN MEDICAL TREATMENT Pfizer Products Inc. (US) 2005-12-07 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
US-20010056060-A1 Treatment of osteoporsis with EP2/EP4 receptor selective agonists CAMERON KIMBERLY O (US) 2001-12-27 US disclosed
EP-1121939-A2 Treatment of osteoporosis with EP2/EP4 receptor selective agonists Pfizer Products Inc. (US) 2001-08-08 EP disclosed
EP-1108426-A2 Use of prostaglandin agonists to treat erectile dysfunction or impotence Pfizer Products Inc. (US) 2001-06-20 EP disclosed
EP-1021410-A1 PROSTAGLANDIN AGONISTS AND THEIR USE TO TREAT BONE DISORDERS PFIZER INC. (US) 2000-07-26 EP disclosed
WO-1999019300-A1 PROSTAGLANDIN AGONISTS AND THEIR USE TO TREAT BONE DISORDERS PFIZER INC. (US) 1999-04-22 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 (5 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-20070135457-A1 Pyrido[2,3-d]pyrimidine-2,4-diamines as pde2 inhibitors PDE12, PDE2A, PDE3A CA12 3632/4885CA1 3745/4885CA2 730/4885
US-20050203086-A1 Methods of treatment using an EP2 selective receptor agonist PTGER2, PTGES2, PTGFR CA12 4228/4885CA1 4613/4885CA2 1473/4885
US-20030078261-A1 Prostaglandin agonists PTGER1, PTGER4, PTGIR CA12 4780/4885CA1 4650/4885CA2 3521/4885
US-20010056060-A1 Treatment of osteoporsis with EP2/EP4 receptor selective agonists PTGER2, PTGER1, PTGER4 CA12 4848/4885CA1 4835/4885CA2 3977/4885
US-20030166631-A1 Pharmaceutical compositions and methods for administering EP2 receptor selective agonists PTGER2, PTGER1, PTGFR CA12 3614/4885CA1 4380/4885CA2 2229/4885

“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.