SCHEMBL3122895

SCHEMBL3122895

NC(CO)(CO)COS(=O)(=O)CCN1CCN(CCO)CC1.O=S(=O)(O)CCN1CCN(CCO)CC1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL15050014 0.94 ALDH1A1 (0.33)
Tromethamine SCHEMBL23041034 0.85 ALDH1A1 (0.36)
Tromethamine SCHEMBL49209 0.85 ALDH1A1 (0.36)
Tromethamine SCHEMBL6320590 0.84 ALDH1A1 (0.35)
SCHEMBL15023848 0.81 ALDH1A1 (0.33)
SCHEMBL3717128 0.79 ALDH1A1 (0.43)
SCHEMBL1232551 0.77 ALDH1A1 (0.33)
SCHEMBL2417 0.77 ALDH1A1 (0.45)
SCHEMBL2229127 0.77 ALDH1A1 (0.45)
SCHEMBL9790 0.77 ALDH1A1 (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9701686-B2 Tricyclopyrazole derivatives NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2017-07-11 US disclosed
US-20150329552-A1 TRICYCLOPYRAZOLE DERIVATIVES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-11-19 US disclosed
US-9127015-B2 Tricyclopyrazole derivatives NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-09-08 US disclosed
US-8981092-B2 Substituted 3,4-dihydro-2H-pyrrolo[1,2-a]pyrazin-1-ones as modulators of protein kinase activity NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-03-17 US disclosed
US-8772279-B2 6,7-dihydroimidazo[1,5-a]pyrazin-8(5H)-one derivatives as protein kinase modulators NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2014-07-08 US disclosed
US-8513241-B2 3,4-dihydro-2H-pyrazino[1,2-A]indol-1-one derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-08-20 US disclosed
US-20130137696-A1 3,4-DIHYDRO-2H-PYRROLO[1,2-A]PYRAZIN-1-ONE DERIVATIVES FOR THE MODULATION OF THE ACTIVITY OF PROTEIN KINASES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-05-30 US disclosed
US-20130029974-A1 6,7-DIHYDROIMIDAZO[1,5-A]PYRAZIN-8(5H)-ONE DERIVATIVES AS PROTEIN KINASE MODULATORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-01-31 US disclosed
EP-2528918-A1 6,7- DIHYDROIMIDAZO [1,5-A]PYRAZIN-8 (5H) - ONE DERIVATIVES AS PROTEIN KINASE MODULATORS Nerviano Medical Sciences S.r.l. (IT) 2012-12-05 EP disclosed
US-20120277214-A1 TRICYCLOPYRAZOLE DERIVATIVES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-11-01 US disclosed
EP-2507244-A1 TRICYCLOPYRAZOLE DERIVATIVES Nerviano Medical Sciences S.r.l. (IT) 2012-10-10 EP disclosed
US-20120232085-A1 3,4-DIHYDRO-2H-PYRAZINO[1,2-A]INDOL-1-ONE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-09-13 US disclosed
EP-2254886-A2 3,4-DIHYDRO-2H-PYRAZINOÝ1,2-A¨INDOL-1-ONE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Nerviano Medical Sciences S.r.l. (IT) 2010-12-01 EP disclosed
WO-2010031816-A1 3,4 DIHYDRO-2H-PYRROLO[1,2-a]PYRAZIN-1-ONE DERIVATIVES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2010-03-25 WO disclosed
WO-2009118411-A2 3,4-DIHYDRO-2H-PYRAZINO[1,2-A]INDOL-1-ONE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2009-10-01 WO disclosed