SCHEMBL7006824

SCHEMBL7006824

Cc1c[c]n(C(C)C)n1

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
SCHEMBL6741096 0.59
SCHEMBL15931358 0.56 CYP1A2 (0.34)
SCHEMBL12313811 0.54
Ammonia Solution, Strong SCHEMBL29168174 0.52 LMNA (0.41)
SCHEMBL2757593 0.51 TOP2A (0.38)
SCHEMBL312626 0.47
SCHEMBL2757589 0.45 GAA (0.40)
SCHEMBL29870823 0.44 ALDH1A1 (0.61)
SCHEMBL9472907 0.42 NOS3 (0.63)
SCHEMBL7489 0.42

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3700903-A1 SUBSTITUTED IMIDAZOPYRIDINE AMIDES AND USE THEREOF Bayer Aktiengesellschaft (DE) 2020-09-02 EP disclosed
US-6649760-B2 Herbicides BAYER AKTIENGESELLSCHAFT (DE) 2003-11-18 US disclosed
CN-1420873-A Substituted phenyluracils BAYER AG (DE) 2003-05-28 CN disclosed
EP-1272478-A1 SUBSTITUTED PHENYLURACILS Bayer Aktiengesellschaft (DE) 2003-01-08 EP disclosed
US-20020173425-A1 Substituted phenyluracils BAYER AKTIENGESELLSCHAFT (DE) 2002-11-21 US disclosed
WO-2001077084-A1 SUBSTITUTED PHENYLURACILS BAYER CROPSCIENCE AG (DE) 2001-10-18 WO disclosed