SCHEMBL2160994

SCHEMBL2160994

COC(=O)c1ccc(CCCN)s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.51
NPSR1 Q6W5P4 2/20 0.46
LMNA P02545 2/20 0.46
PPARG P37231 1/20 0.46
NCOA2 Q15596 1/20 0.46
NCOA1 Q15788 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.46
MRGPRX4 Q96LA9 1/20 0.46
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
ATM Q13315 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ALDH1A1 P00352 2/20 0.44
PRNP P04156 1/20 0.44
RECQL P46063 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
POLB P06746 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PARP1 P09874 1/20 0.41
TP53 P04637 1/20 0.40

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 SCHEMBL5725652 0.98 HPGD (0.50) HPGDNPSR1LMNAPPARGNCOA2
SCHEMBL2160349 0.95 HPGD (0.54) HPGDNPSR1LMNAPPARGNCOA2
SCHEMBL2412998 0.93 HPGD (0.50) HPGDNPSR1LMNAPPARGNCOA2
Hydrochloric Acid SCHEMBL2410455 0.92 HPGD (0.49) HPGDNPSR1LMNAPPARGNCOA2
SCHEMBL7211399 0.85 HPGD (0.54) HPGDNPSR1LMNAPPARGNCOA2
SCHEMBL2162296 0.85 HPGD (0.52) HPGDNPSR1LMNAPPARGNCOA2
SCHEMBL2162982 0.84 HPGD (0.55) HPGDNPSR1LMNAPPARGNCOA2
SCHEMBL317871 0.84 HPGD (0.55) HPGDNPSR1LMNAPPARGNCOA2
SCHEMBL2162352 0.84 HPGD (0.51) HPGDNPSR1LMNAPPARGNCOA2
SCHEMBL27621806 0.84 HPGD (0.55) HPGDNPSR1LMNAPPARGNCOA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2528908-B1 THERAPEUTIC AGENTS FOR TREATMENT OF OCULAR HYPERTENSION ALLERGAN INC (US) 2019-03-13 EP disclosed
US-9090584-B2 Therapeutic agents for treatment of ocular hypertension ALLERGAN, INC. (US) 2015-07-28 US disclosed
EP-2528908-A1 THERAPEUTIC AGENTS FOR TREATMENT OF OCULAR HYPERTENSION Allergan, Inc. (US) 2012-12-05 EP disclosed
WO-2011094231-A1 THERAPEUTIC AGENTS FOR TREATMENT OF OCULAR HYPERTENSION ALLERGAN, INC. (US) 2011-08-04 WO disclosed
US-20110184055-A1 THERAPEUTIC AGENTS FOR TREATMENT OF OCULAR HYPERTENSION ALLERGAN, INC. (US) 2011-07-28 US disclosed
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
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
EP-1601351-A1 USE OF EP2 SELECTIVE RECEPTOR AGONISTS IN MEDICAL TREATMENT Pfizer Products Inc. (US) 2005-12-07 EP disclosed
US-6124314-A A PROSTAGLANDIN AGONISTS FOR TREATING VERTEBRATE BONE DISORDERS PFIZER INC. (US) 2000-09-26 US disclosed
EP-1021410-A1 PROSTAGLANDIN AGONISTS AND THEIR USE TO TREAT BONE DISORDERS PFIZER INC. (US) 2000-07-26 EP disclosed
EP-1000619-A2 Method for treating glaucoma Pfizer Products Inc. (US) 2000-05-17 EP disclosed
EP-0946501-A1 PREVENTION OF LOSS AND RESTORATION OF BONE MASS BY CERTAIN PROSTAGLANDIN AGONISTS PFIZER INC. (US) 1999-10-06 EP disclosed
EP-0911321-A2 Compounds for the treatment of osteoporosis PFIZER INC. (US) 1999-04-28 EP disclosed
WO-1999019300-A1 PROSTAGLANDIN AGONISTS AND THEIR USE TO TREAT BONE DISORDERS PFIZER INC. (US) 1999-04-22 WO disclosed
WO-1998028264-A1 PREVENTION OF LOSS AND RESTORATION OF BONE MASS BY CERTAIN PROSTAGLANDIN AGONISTS PFIZER INC. (US) 1998-07-02 WO disclosed
US-5166218-A Antilipemic agents or antiglycemic agents HOFFMANN-LA ROCHE INC. (US) 1992-11-24 US disclosed
US-5064863-A Catabolic activity, obesity, diabetes HOFFMANN-LA ROCHE INC. (US) 1991-11-12 US disclosed
US-4652679-A Aziridine and phenethanolamine derivatives having antiobesity and anti-hyperglycaemic acitivity HOFFMANN-LA ROCHE INC. (US) 1987-03-24 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 (1 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-20110184055-A1 THERAPEUTIC AGENTS FOR TREATMENT OF OCULAR HYPERTENSION PTGIR, PTGIS, AGTR2 HPGD 98/4885NPSR1 1074/4885LMNA 3581/4885

“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.