SCHEMBL16163176

SCHEMBL16163176

CC(C)CCn1c(CN2C(=O)C3(CCCC3)c3ccccc32)nc2cc(CN)ccc21

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
SCHEMBL16163160 0.98
SCHEMBL16163287 0.97
SCHEMBL16163135 0.89
SCHEMBL16163229 0.88 TSHR (0.51)
SCHEMBL22495141 0.87 TSHR (0.40)
SCHEMBL19470922 0.86
SCHEMBL16163321 0.86 TSHR (0.51)
SCHEMBL16163128 0.85
SCHEMBL19470936 0.84
SCHEMBL16163238 0.84 TSHR (0.53)

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-9809575-B2 Pharmaceutical compounds ReViral Limited (GB) 2017-11-07 US claimed
EP-2776416-B1 PHARMACEUTICAL COMPOUNDS RE VIRAL LTD (GB) 2016-01-13 EP claimed
US-20140308282-A1 PHARMACEUTICAL COMPOUNDS re: Viral Ltd (GB) 2014-10-16 US claimed
US-9809575-B2 Pharmaceutical compounds ReViral Limited (GB) 2017-11-07 US disclosed
EP-2776416-B1 PHARMACEUTICAL COMPOUNDS RE VIRAL LTD (GB) 2016-01-13 EP disclosed
US-20140308282-A1 PHARMACEUTICAL COMPOUNDS re: Viral Ltd (GB) 2014-10-16 US disclosed