SCHEMBL1019316

SCHEMBL1019316

C#CCC(C)(C)CCO

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
SCHEMBL7696998 0.83 CYP4F2 (0.33)
SCHEMBL3221343 0.79
SCHEMBL3495087 0.78
SCHEMBL13650261 0.77
SCHEMBL22616854 0.76
SCHEMBL37771 0.73
SCHEMBL8960812 0.69
SCHEMBL22750531 0.69
SCHEMBL1142967 0.69
SCHEMBL8960551 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230093861-A1 RAPAMYCIN ANALOGS AS MTOR INHIBITORS Revolution Medicines, Inc. 2023-03-30 US disclosed
US-20210094975-A1 RAPAMYCIN ANALOGS AS MTOR INHIBITORS Revolution Medicines, Inc. 2021-04-01 US disclosed
EP-3619216-A1 RAPAMYCIN ANALOGS AS MTOR INHIBITORS Revolution Medicines, Inc. (US) 2020-03-11 EP disclosed
WO-2018204416-A1 RAPAMYCIN ANALOGS AS MTOR INHIBITORS Revolution Medicines, Inc. (US) 2018-11-08 WO disclosed
EP-2459560-B1 RING-ANNULATED DIHYDROPYRROLO[2,L-A]ISOQUINOLINES MERCK SHARP & DOHME (NL) 2015-08-19 EP disclosed
EP-2459560-B1 RING-ANNULATED DIHYDROPYRROLO[2,L-A]ISOQUINOLINES MERCK SHARP & DOHME (NL) 2015-08-19 EP disclosed
US-8431564-B2 Ring-annulated dihydropyrrolo[2,1-α]isoquinolines MERCK SHARP & DOHME B.V. (NL) 2013-04-30 US disclosed
US-8431564-B2 Ring-annulated dihydropyrrolo[2,1-α]isoquinolines MERCK SHARP & DOHME B.V. (NL) 2013-04-30 US disclosed
US-8431564-B2 Ring-annulated dihydropyrrolo[2,1-α]isoquinolines MERCK SHARP & DOHME B.V. (NL) 2013-04-30 US disclosed
US-8247595-B2 Organic sulfur compound and its use for controlling harmful arthropod SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-21 US disclosed
EP-2459560-A1 RING-ANNULATED DIHYDROPYRROLO[2,L-A]ISOQUINOLINES MSD Oss B.V. (NL) 2012-06-06 EP disclosed
US-20110028450-A1 Ring-annulated dihydropyrrolo[2,1-alpha]isoquinolines N.V. ORGANON (NL) 2011-02-03 US disclosed
US-20110028450-A1 Ring-annulated dihydropyrrolo[2,1-alpha]isoquinolines N.V. ORGANON (NL) 2011-02-03 US disclosed
US-20110028450-A1 Ring-annulated dihydropyrrolo[2,1-alpha]isoquinolines N.V. ORGANON (NL) 2011-02-03 US disclosed
WO-2011012600-A1 RING-ANNULATED DIHYDROPYRROLO[2,L-A]ISOQUINOLINES N.V. ORGANON (NL) 2011-02-03 WO disclosed
EP-2152668-B1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPODS SUMITOMO CHEMICAL CO (JP) 2011-01-12 EP disclosed
US-20100160434-A1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 US disclosed
EP-2152668-A1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPOD Sumitomo Chemical Company, Limited (JP) 2010-02-17 EP disclosed
WO-2008143338-A1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-11-27 WO disclosed