SCHEMBL2233428

SCHEMBL2233428

ClCc1cccc(-c2nnn[nH]2)c1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
IDO1 P14902 2/20 0.33
MAP2K4 P45985 1/20 0.32
PIM1 P11309 1/20 0.31
PIM3 Q86V86 1/20 0.31
AURKB Q96GD4 1/20 0.31
CXCR2 P25025 1/20 0.31
NOTUM Q6P988 1/20 0.31
MRGPRX4 Q96LA9 2/20 0.31
PRKCI P41743 1/20 0.31

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
SCHEMBL7810819 0.83 CDK8 (0.41) PIM1PIM3AURKB
SCHEMBL17548483 0.83 CYP4F2 (0.38) TSHRIDO1PIM1PIM3AURKB
SCHEMBL5950532 0.83 PIM1 (0.31) IDO1PIM1PIM3AURKBNOTUM
SCHEMBL2056403 0.83 NOTUM (0.47) IDO1MAP2K4NOTUM
SCHEMBL6740112 0.83 NOTUM (0.34) IDO1PIM1PIM3AURKBCXCR2
SCHEMBL3576499 0.83 PRKCI (0.49) MAP2K4PRKCI
SCHEMBL1557945 0.83 PIM1 (0.34) IDO1PIM1PIM3AURKBNOTUM
SCHEMBL6958334 0.82 HRH3 (0.41) TSHR
SCHEMBL6963004 0.82 MAOA (0.41)
Hydrochloric Acid SCHEMBL7808326 0.82 CDK8 (0.40)

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
US-8440110-B2 Method for producing metal particle dispersion, conductive ink using metal particle dispersion produced by such method, and conductive coating film TOYO INK MFG CO., LTD. (JP) 2013-05-14 US disclosed
US-20110175040-A1 METHOD FOR PRODUCING METAL PARTICLE DISPRESION, CONDUCTIVE INK USING METAL PARTICLE DISPERSION PRODUCED BY SUCH METHOD, AND CONDUCTIVE COATING FILM TOYO INK MFG CO., LTD. (JP) 2011-07-21 US disclosed
EP-0891362-B1 PYRROLOPYRROLONE DERIVATIVES AS INHIBITORS OF NEUTROPHIL ELASTASE GLAXO GROUP LTD (GB) 2004-03-17 EP disclosed
CN-1067075-C Pyrrolopyrrolone derivatives as inhibitors of neutrophil elastase GLAXO GROUP LTD (GB) 2001-06-13 CN disclosed
US-6215002-B1 CYCLIZATION, DEBLOCKING, DEPROTECTION, SULFONATION, CONDENSATION, AMIDATION; ANTIINFLAMMATORY AGENTS; RESPIRATORY SYSTEM DISORDERS GLAXO WELLCOME INC. 2001-04-10 US disclosed
US-6057457-A ENZYME INHIBITORS FOR PROTEASE OR ENZYMES OF HYDROLYSIS GLAXO WELLCOME INC. (US) 2000-05-02 US disclosed
US-5994344-A BRONCHITIS THERAPY GLAXO WELLCOME INC. (US) 1999-11-30 US disclosed
CN-1219935-A Pyrrolopyrrolone derivatives as inhibitors of neutrophil elastase GLAXO GROUP LTD (GB) 1999-06-16 CN disclosed
EP-0891362-A1 PYRROLOPYRROLONE DERIVATIVES AS INHIBITORS OF NEUTROPHIL ELASTASE GLAXO GROUP LIMITED (GB) 1999-01-20 EP disclosed
WO-1997036903-A1 PYRROLOPYRROLONE DERIVATIVES AS INHIBITORS OF NEUTROPHIL ELASTASE GLAXO GROUP LIMITED (GB) 1997-10-09 WO disclosed