SCHEMBL25866852

SCHEMBL25866852

CCCCCCCCc1ccc(N(c2cccc(-c3cccc(-c4cccc(N(c5ccccc5)c5ccccc5)c4)c3)c2)c2cccc(-c3cccc(-c4cccc(N(c5ccccc5)c5ccc6c(c5)C(CCCCCC)(CCCCCC)c5ccccc5-6)c4)c3)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.37
HSD11B1 P28845 1/20 0.36
STAT3 P40763 3/20 0.35
KCNH2 Q12809 1/20 0.35
RARB P10826 8/20 0.34
HTR2A P28223 1/20 0.34
CTSV O60911 1/20 0.33
CTSL P07711 1/20 0.33
RARA P10276 1/20 0.33
RARG P13631 1/20 0.33
MMP2 P08253 2/20 0.33
MMP9 P14780 2/20 0.33
MMP8 P22894 2/20 0.33
MMP13 P45452 2/20 0.33
LPL P06858 1/20 0.32
LIPG Q9Y5X9 1/20 0.32

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
SCHEMBL25866826 0.97 HSD11B1 (0.37) GPR3HSD11B1STAT3KCNH2RARB
SCHEMBL25866838 0.97 HSD11B1 (0.37) GPR3HSD11B1STAT3KCNH2RARB
SCHEMBL25866887 0.95 RARB (0.38) GPR3HSD11B1STAT3KCNH2RARB
SCHEMBL25866907 0.95 RARB (0.38) GPR3HSD11B1STAT3KCNH2RARB
SCHEMBL25866861 0.95 RARB (0.38) GPR3HSD11B1STAT3KCNH2RARB
SCHEMBL25866859 0.94 RARB (0.39) GPR3HSD11B1STAT3RARBCTSV
SCHEMBL25866883 0.94 RARB (0.39) GPR3HSD11B1STAT3RARBCTSV
SCHEMBL25866849 0.93 PDK2 (0.34) MMP2MMP9MMP8MMP13
SCHEMBL25866870 0.93 RARB (0.39) GPR3HSD11B1STAT3KCNH2RARB
SCHEMBL25866881 0.93 RARB (0.39) GPR3HSD11B1STAT3KCNH2RARB

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
US-11702542-B2 Composition including polymer, interlayer prepared from the composition, and device comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-18 US disclosed