SCHEMBL10310413

SCHEMBL10310413

CCCON1C(C)(C)CC(N2CCN(C3=CC(C)(C)N(OCCC)C(C)(C)C3Cl)CC2)=C(Cl)C1(C)C

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
SCHEMBL12941663 0.85 — —
SCHEMBL12941661 0.69 — —
SCHEMBL10310423 0.64 — —
SCHEMBL10310410 0.61 PRKDC (0.33) —
SCHEMBL893078 0.58 GAA (0.38) —
SCHEMBL1441368 0.54 — —
SCHEMBL10310464 0.54 MEN1 (0.33) —
SCHEMBL10310446 0.53 — —
SCHEMBL6721327 0.52 — —
SCHEMBL10310401 0.52 MAPT (0.35) —

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-20120178829-A1 BI - OR TRICYCLIC STERICALLY HINDERED ALKOXYAMINES AND PROCESS FOR THEIR PREPARATION BASF SE (DE) 2012-07-12 — — US disclosed
US-20120178829-A1 BI - OR TRICYCLIC STERICALLY HINDERED ALKOXYAMINES AND PROCESS FOR THEIR PREPARATION BASF SE (DE) 2012-07-12 — — US disclosed
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