SCHEMBL1265337

SCHEMBL1265337

Nc1ccc(NS(=O)(=O)c2cccc(Cl)c2Cl)c(F)c1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGES2 Q9H7Z7 9/20 0.64
ACLY P53396 2/20 0.60
SGK1 O00141 3/20 0.54
SLC40A1 Q9NP59 1/20 0.48
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
GPR55 Q9Y2T6 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
FSCN1 Q16658 1/20 0.46

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
SCHEMBL2146366 0.84 PTGES2 (0.61) PTGES2ACLYSGK1SLC40A1FSCN1
SCHEMBL13875348 0.84 PTGES2 (0.70) PTGES2ACLYSGK1SLC40A1
SCHEMBL7852262 0.81 PTGES2 (0.68) PTGES2ACLYSGK1SLC40A1
SCHEMBL30897292 0.81 PTGES2 (0.61) PTGES2ACLYSGK1SLC40A1
Hydrochloric Acid SCHEMBL31588089 0.80 PTGES2 (0.60) PTGES2ACLYSGK1SLC40A1
SCHEMBL27143523 0.80 PTGES2 (0.67) PTGES2ACLYSGK1SLC40A1FSCN1
SCHEMBL29907260 0.80 PTGES2 (0.67) PTGES2ACLYSGK1SLC40A1FSCN1
SCHEMBL1265855 0.80 PTGES2 (0.56) PTGES2ACLYSGK1SLC40A1MAPT
SCHEMBL3787762 0.78 PTGES2 (1.00) PTGES2ACLYSGK1SLC40A1FSCN1
SCHEMBL28513321 0.77 MEN1 (0.59) PTGES2SGK1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1751136-B1 NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER AMGEN INC (US) 2014-07-02 EP disclosed
US-8476434-B2 Protein kinase modulators and method of use AMGEN INC. (US) 2013-07-02 US disclosed
US-20110201602-A1 PROTEIN KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2011-08-18 US disclosed
US-7880000-B2 N-(5-(1,1- dimethylethyl)-3- isoxazolyl)-4-methyl-3- ((3-(4-pyrimidinyl)-2- pyridinyl)amino)benzamide, used for treating breast cancer or rheumatoid arthritis AMGEN INC. (US) 2011-02-01 US disclosed
EP-1751136-A2 NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER AMGEN INC. (US) 2007-02-14 EP disclosed
US-20060009453-A1 Protein kinase modulators and method of use AMGEN INC. 2006-01-12 US disclosed
WO-2005113494-A2 NITROGENATED HETEROCYCLIC DERIVATIVES AS PROTEIN KINASE MODULATORS AND USE FOR THE TREATMENT OF ANGIOGENESIS AND CANCER AMGEN INC. (US) 2005-12-01 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 (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-20060009453-A1 Protein kinase modulators and method of use PHKG1, PRKCH, BMP2K PTGES2 467/4885ACLY 2046/4885SGK1 367/4885
US-20110201602-A1 PROTEIN KINASE MODULATORS AND METHOD OF USE GRK4, MAP4K5, GRK5 PTGES2 438/4885ACLY 2645/4885SGK1 417/4885

“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.