SCHEMBL28877620

SCHEMBL28877620

BrC1(Br)C2CC3CC(C2)CC1(c1ccccc1)C3

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.41
GRIN2D O15399 1/20 0.40
GRIN3B O60391 1/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2A Q12879 1/20 0.40
GRIN2B Q13224 1/20 0.40
GRIN2C Q14957 1/20 0.40
GRIN3A Q8TCU5 1/20 0.40
P2RX7 Q99572 4/20 0.37
ALOX5AP P20292 1/20 0.36
MAOB P27338 6/20 0.35
MAOA P21397 3/20 0.35
FAAH O00519 1/20 0.35
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
GFER P55789 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL6939002 0.78 HSD11B1 (0.42) HSD11B1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL11547069 0.77 HSD11B1 (0.41) HSD11B1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4846118 0.77 GRIN2D (0.47) HSD11B1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6850950 0.77 HSD11B1 (0.41) HSD11B1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4172174 0.74 GRIN2D (0.47) HSD11B1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6767079 0.73 HSD11B1 (0.41) HSD11B1GRIN2DGRIN3BGRIN1GRIN2A
Bromide SCHEMBL27584845 0.72 GRIN2D (0.46) HSD11B1GRIN2DGRIN3BGRIN1GRIN2A
Bromide SCHEMBL27599338 0.72 GRIN2D (0.46) HSD11B1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL27584838 0.72 GRIN2D (0.33) HSD11B1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL181479 0.70 GRIN2D (0.62) HSD11B1GRIN2DGRIN3BGRIN1GRIN2A

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
CN-115260871-A Preparation method of high-temperature-resistant epoxy resin paint 刘翔 2022-11-01 CN claimed
CN-115260871-A Preparation method of high-temperature-resistant epoxy resin paint 刘翔 2022-11-01 CN disclosed
CN-115260871-A Preparation method of high-temperature-resistant epoxy resin paint 刘翔 2022-11-01 CN disclosed