SCHEMBL15344711

SCHEMBL15344711

C[C@H](C1=C(P(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)C=CC1)P(C(C)(C)C)C(C)(C)C

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
SCHEMBL12902201 0.79 PDE2A (0.30)
SCHEMBL15381142 0.72
SCHEMBL14878262 0.71 ESR1 (0.31)
SCHEMBL16330308 0.71
SCHEMBL16327573 0.70
SCHEMBL12901959 0.69
SCHEMBL13631017 0.68
SCHEMBL19286230 0.68 MEN1 (0.42)
SCHEMBL15381147 0.68
SCHEMBL17470176 0.65 CYP3A4 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9403766-B2 Intermediates for producing NEP inhibitors or prodrugs thereof NOVARTIS AG (CH) 2016-08-02 US disclosed
US-20160060217-A1 Processes HOOK DAVID (CH) 2016-03-03 US disclosed
US-9227934-B2 Processes for producing NEP inhibitors or prodrugs thereof NOVARTIS AG (CH) 2016-01-05 US disclosed
US-20150246881-A1 Processes NOVARTIS AG (CH) 2015-09-03 US disclosed
US-9061973-B2 Processes for producing NEP inhibitors or prodrugs thereof NOVARTIS PHARMACEUTICALS CORPORATION (US) 2015-06-23 US disclosed
US-8946481-B2 Process for preparing biaryl substituted 4-amino butyric acid or derivatives thereof and their use in the production of NEP inhibitors NOVARTIS AG (CH) 2015-02-03 US disclosed
US-20140243546-A1 Processes NOVARTIS AG (CH) 2014-08-28 US disclosed
US-8580974-B2 Processes NOVARTIS AG (CH) 2013-11-12 US disclosed
US-20130281747-A1 COBALT PHOSPHINE ALKYL COMPLEXES FOR THE ASYMMETRIC HYDROGENATION OF ALKENES NATIONAL SCIENCE FOUNDATION 2013-10-24 US disclosed
US-20130066101-A1 PROCESS FOR PREPARING BIARYL SUBSTITUTED 4-AMINO BUTYRIC ACID OR DERIVATIVES THEREOF AND THEIR USE IN THE PRODUCTION OF NEP INHIBITORS NOVARTIS AG (CH) 2013-03-14 US disclosed
US-7935829-B2 Manufacture of thiolactones DSM IP ASSETS B.V. (NL) 2011-05-03 US disclosed
US-20110046397-A1 NEW PROCESSES NOVARTIS PHARMACEUTICALS CORPORATION 2011-02-24 US disclosed
US-20090048455-A1 Manufacture of Thiolactones DSM IP ASSETS B.V. (NL) 2009-02-19 US disclosed