SCHEMBL17701596

SCHEMBL17701596

BCNC(=O)CSCC

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
SCHEMBL15948655 0.81
SCHEMBL17705131 0.77 CYP2D6 (0.55)
SCHEMBL16123439 0.77 MCL1 (0.47)
SCHEMBL23489532 0.76 MEN1 (0.54)
SCHEMBL17701600 0.76 HPGD (0.41)
SCHEMBL15948601 0.74 CASP2 (0.48)
SCHEMBL20243588 0.74 MEN1 (0.37)
SCHEMBL14559794 0.73
SCHEMBL16629055 0.73
SCHEMBL17245246 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170252410-A1 INSULIN VITAMIN D CONJUGATES EXTEND BIOSCIENCES, INC. (US) 2017-09-07 US disclosed
US-20170216449-A1 THERAPEUTIC VITAMIN D CONJUGATES EXTEND BIOSCIENCES, INC. (US) 2017-08-03 US disclosed
US-9616109-B2 Insulin vitamin D conjugates EXTEND BIOSCIENCES, INC. (US) 2017-04-11 US disclosed
US-9585934-B2 Therapeutic vitamin D conjugates EXTEND BIOSCIENCES, INC. (US) 2017-03-07 US disclosed
US-20160113993-A1 THERAPEUTIC VITAMIN D CONJUGATES EXTEND BIOSCIENCES, INC. (US) 2016-04-28 US disclosed
US-20160114049-A1 RNAi VITAMIN D CONJUGATES EXTEND BIOSCIENCES, INC. (US) 2016-04-28 US disclosed
US-20160114001-A1 INSULIN VITAMIN D CONJUGATES EXTEND BIOSCIENCES, INC. (US) 2016-04-28 US disclosed