SCHEMBL24347883

SCHEMBL24347883

CC(C)(C)C1CCC(C(C)(C)C(C)(C)C2CCN(C(C)(C)C)CC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.34
KCNH2 Q12809 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
EPHX2 P34913 1/20 0.33
HSD11B1 P28845 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
SCHEMBL23594021 0.91 GRIN2D (0.30) KCNH2
SCHEMBL2706991 0.91 CYP2D6 (0.38) CYP2D6KCNH2HRH3EPHX2HSD11B1
SCHEMBL13141334 0.82 EPHX2 (0.33) CYP2D6KCNH2HRH3EPHX2HSD11B1
SCHEMBL25988568 0.82 ATM (0.31)
SCHEMBL2732106 0.82 CYP2D6 (0.34) CYP2D6KCNH2HRH3
SCHEMBL20043231 0.82 CYP2D6 (0.34) CYP2D6KCNH2HRH3
SCHEMBL12210940 0.81
SCHEMBL20685148 0.80 CYP2D6 (0.33) CYP2D6KCNH2HRH3
SCHEMBL23594119 0.78 MEN1 (0.36) CYP2D6KCNH2HRH3
SCHEMBL24827910 0.78 MEN1 (0.36) CYP2D6KCNH2HRH3

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-11584853-B2 Dichroic dye and liquid crystal composition DIC CORPORATION (JP) 2023-02-21 US disclosed
US-20220073750-A1 DICHROIC DYE AND LIQUID CRYSTAL COMPOSITION DIC CORPORATION (JP) 2022-03-10 US disclosed