SCHEMBL15967700

SCHEMBL15967700

CC1(C)C=CC=C(P(C2CCCCC2)C2CCCCC2)[C@@H]1c1ccccc1P(C1CCCCC1)C1CCCCC1

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
SCHEMBL22181782 0.74
SCHEMBL15170112 0.73 ROCK2 (0.31)
SCHEMBL18396109 0.70 DRD1 (0.36)
SCHEMBL5572903 0.69 MEN1 (0.32)
SCHEMBL1315359 0.68 ROCK2 (0.35)
SCHEMBL16694457 0.68
SCHEMBL1314189 0.66 ROCK2 (0.33)
SCHEMBL17583591 0.65 ROCK2 (0.33)
SCHEMBL12034393 0.64 BCHE (0.31)
SCHEMBL301552 0.64 NPC1 (0.38)

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 6 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-20140243546-A1 Processes NOVARTIS AG (CH) 2014-08-28 US disclosed