SCHEMBL20647844

SCHEMBL20647844

CCN(CC)C1=CC2OC3=CC(=[N+](CC)CC)C=CC3=C(c3ccc(N=C=S)cc3C(=O)O)C2C=C1

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
SCHEMBL14985819 0.72 MEN1 (0.30) —
SCHEMBL15318100 0.71 MEN1 (0.31) —
SCHEMBL10110877 0.63 PTPN1 (0.31) —
SCHEMBL14367912 0.61 KDM4C (0.34) —
SCHEMBL16602269 0.61 KDM4C (0.32) —
SCHEMBL8739765 0.61 MEN1 (0.31) —
SCHEMBL14392241 0.60 KDM4E (0.36) —
SCHEMBL12216725 0.59 MEN1 (0.55) —
Hydrochloric Acid SCHEMBL29349953 0.59 MEN1 (0.54) —
Hydrochloric Acid SCHEMBL16593584 0.59 MEN1 (0.54) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3483610-A1 FUNCTIONALIZED CHROMOPHORIC POLYMER DOTS AND BIOCONJUGATES THEREOF University Of Washington Center For Commercialization (US) 2019-05-15 — — EP disclosed
US-10191060-B2 Functionalized chromophoric polymer dots and bioconjugates thereof UNIVERSITY OF WASHINGTON (US) 2019-01-29 — — US disclosed
EP-2499213-B1 FUNCTIONALIZED CHROMOPHORIC POLYMER DOTS AND BIOCONJUGATES THEREOF UNIV OF WASHINGTON CENTER FOR COMMERCIALIZATION (US) 2019-01-16 — — EP disclosed
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