SCHEMBL1817086

SCHEMBL1817086

C1=CC(NC2c3cccc4cccc(c34)C3SC23)c2cccc3cccc1c23

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
SCHEMBL6541973 0.80 ALDH1A1 (0.32)
SCHEMBL5605098 0.70 KDM4E (0.31)
SCHEMBL28470474 0.70 ALDH1A1 (0.30)
SCHEMBL9816575 0.69
SCHEMBL9816510 0.69
SCHEMBL3421831 0.69 ALDH1A1 (0.33)
SCHEMBL11480545 0.68
SCHEMBL27594499 0.65 CA12 (0.32)
SCHEMBL27569298 0.65 SIGMAR1 (0.35)
SCHEMBL17188010 0.65 ALDH1A1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7952694-B2 Optical system and methods for monitoring erosion of electrostatic chuck edge bead materials LAM RESEARCH CORPORATION (US) 2011-05-31 US disclosed