SCHEMBL23399264

SCHEMBL23399264

CCCCn1nc(C(C)C)c(CC)c1O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.31
CNR1 P21554 2/20 0.31
CNR2 P34972 2/20 0.31
GCGR P47871 1/20 0.30

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
SCHEMBL23403168 0.90 GCGR (0.30) GCGR
SCHEMBL23402436 0.89 GCGR (0.35) GCGR
SCHEMBL23399160 0.89 GCGR (0.32) ESR1CNR1CNR2GCGR
SCHEMBL23399713 0.87 ESR1 (0.30) ESR1CNR1CNR2
SCHEMBL23400656 0.82 GCGR (0.32) GCGR
SCHEMBL23400075 0.82 GCGR (0.35) GCGR
SCHEMBL23399204 0.81 ESR1 (0.32) ESR1CNR1CNR2
SCHEMBL23402758 0.81 NR1H3 (0.33) ESR1CNR1CNR2GCGR
SCHEMBL23401441 0.79 GCGR (0.30) GCGR
SCHEMBL23401386 0.77 MPO (0.34) ESR1

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
EP-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed