SCHEMBL9239669

SCHEMBL9239669

CCCCCCOC(=O)CC(C)c1ccc(-c2ncc(CCCC)cn2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.54
RAB9A P51151 7/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
KDM4E B2RXH2 3/20 0.43
HSD17B10 Q99714 3/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 6/20 0.41
LMNA P02545 2/20 0.41
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
MMP13 P45452 1/20 0.41
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL9237917 0.98 RARB (0.57) RARBRAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL9240809 0.98 RARB (0.57) RARBRAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL9236036 0.98 RARB (0.57) RARBRAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL9241229 0.98 RARB (0.57) RARBRAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL9237564 0.98 RARB (0.57) RARBRAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL9240469 0.96 RARB (0.51) RARBRAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL9237200 0.90 RARB (0.48) RARBRAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL9238986 0.90 RARB (0.48) RARBRAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL9235220 0.90 RARB (0.48) RARBRAB9ASMN1; SMN2KDM4EHSD17B10
SCHEMBL9238972 0.90 RARB (0.48) RARBRAB9ASMN1; SMN2KDM4EHSD17B10

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
US-5389290-A Ferroelectric liquid crystalline materials MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-02-14 US disclosed
US-5089168-A Stable ferroelectric liquid crystals MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-02-18 US disclosed
US-4834904-A FERROELECTRIC LIQUID CRYSTALS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-05-30 US disclosed