SCHEMBL2633201

SCHEMBL2633201

NC(N)C(C(N)N)C(C(N)N)C(N)N

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
SCHEMBL11664834 0.86
SCHEMBL14885531 0.76 ALDH1A1 (0.31)
SCHEMBL1997318 0.68 ALDH1A1 (0.33)
SCHEMBL149877 0.57
SCHEMBL444662 0.54
SCHEMBL537196 0.54
Ammonia Solution, Strong SCHEMBL5202738 0.51
Hydrochloric Acid SCHEMBL9549754 0.51
SCHEMBL23628375 0.46
SCHEMBL299720 0.46

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8313957-B2 Fluorescent sensor based on two fluorescent moieties, one of which is a semiconductor nanocrystal, and methods of using and making MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-11-20 US disclosed
US-20120094390-A1 Fluorescent Sensor and Methods MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2012-04-19 US disclosed
US-8101430-B2 Fluorescent sensor based on two fluorescent moieties one of which is a semiconductor nanocrystal and methods of using and making MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-01-24 US disclosed
US-20090221088-A1 Fluorescent Sensor and Methods NATIONAL SCIENCE FOUNDATION 2009-09-03 US disclosed