SCHEMBL17878150

SCHEMBL17878150

CC(/C=C/CN)CN

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
SCHEMBL28414937 1.00
SCHEMBL16790278 0.80
SCHEMBL19302264 0.80
SCHEMBL4584289 0.80
Water SCHEMBL31456288 0.78
Hydrochloric Acid SCHEMBL10605689 0.78
SCHEMBL23109744 0.76
SCHEMBL3822156 0.76
SCHEMBL24214279 0.76
SCHEMBL11814556 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160184449-A1 PEPTIDE-AND AMINE-MODIFIED GLUCAN PARTICLES FOR DELIVERY OF THERAPEUTIC CARGOES UNIVERSITY OF MASSACHUSETTS 2016-06-30 US disclosed
US-20160184449-A1 PEPTIDE-AND AMINE-MODIFIED GLUCAN PARTICLES FOR DELIVERY OF THERAPEUTIC CARGOES UNIVERSITY OF MASSACHUSETTS 2016-06-30 US disclosed