SCHEMBL1946831

SCHEMBL1946831

Cc1cc(C)c([N+]2=CN(C34CC5CC(CC(C5)C3)C4)CC2)c(C)c1.F[B-](F)(F)F

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
SCHEMBL1178759 0.95 ALDH1A1 (0.30) —
SCHEMBL1946824 0.72 HRH3 (0.32) —
SCHEMBL820220 0.70 — —
SCHEMBL819057 0.70 — —
SCHEMBL1950967 0.68 ALDH1A1 (0.32) —
SCHEMBL1946829 0.66 — —
SCHEMBL6098447 0.65 ALDH1A1 (0.31) —
SCHEMBL18527599 0.65 LMNA (0.32) —
SCHEMBL12626979 0.65 HRH3 (0.35) —
SCHEMBL1947979 0.63 CCR5 (0.36) —

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
EP-2151446-B1 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand RIMTEC CORP (JP) 2016-04-13 — — EP disclosed
EP-2151445-B1 Process for the preparation of bidentate Schiff base ruthenium catalysts containing a salicylaldimine-type ligand RIMTEC CORP (JP) 2015-02-18 — — EP disclosed
US-8338613-B2 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand RIMTEC CORPORATION (JP) 2012-12-25 — — US disclosed
US-20110137043-A1 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand TELENE S.A.S. (FR) 2011-06-09 — — US disclosed
US-20110065925-A1 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand TELENE S.A.S. (FR) 2011-03-17 — — US disclosed
EP-2151446-A1 Process for the preparation of bidentate schiff base ruthenium catalysts containing a salicylaldimine-type ligand Telene SAS (FR) 2010-02-10 — — EP disclosed
EP-2151445-A1 Process for the preparation of bidentate Schiff base ruthenium cataysts containing a saliclyldimine-type ligand Telene SAS (FR) 2010-02-10 — — EP disclosed
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