SCHEMBL23400445

SCHEMBL23400445

CCCCc1nn(C(C)C)c(CC(C)C)c1O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL23399230 0.90
SCHEMBL23403002 0.89 FFAR1 (0.32) FFAR1
SCHEMBL27139987 0.88 FFAR1 (0.31) FFAR1
SCHEMBL23398875 0.88 FFAR1 (0.33) FFAR1
SCHEMBL27142248 0.87 FFAR1 (0.31) FFAR1
SCHEMBL23401260 0.87 FFAR1 (0.31) FFAR1
SCHEMBL23399407 0.84 FFAR1 (0.31) FFAR1
SCHEMBL23400563 0.83 KDM4E (0.33)
SCHEMBL23401515 0.83 KDM4E (0.34)
SCHEMBL23399942 0.83 FFAR1 (0.33) FFAR1

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-4326783-A1 POLYMERIZATION INHIBITORS BASF SE (DE) 2024-02-28 EP disclosed
WO-2022223336-A1 POLYMERIZATION INHIBITORS BASF SE (DE) 2022-10-27 WO disclosed
EP-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed