SCHEMBL28268752

SCHEMBL28268752

Cc1cc(C(=O)CC(=O)CCC(F)(F)F)c(C)cc1Br

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR27 Q9NS67 1/20 0.33
NOTUM Q6P988 1/20 0.33
GALR3 O60755 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
MTOR P42345 1/20 0.32
HPGD P15428 3/20 0.31
CHRNA1 P02708 1/20 0.31
CHRNG P07510 1/20 0.31
CHRNB1 P11230 1/20 0.31
CHRNB2 P17787 1/20 0.31
SLC6A2 P23975 1/20 0.31
CHRNB4 P30926 1/20 0.31
SLC6A4 P31645 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
SLC6A3 Q01959 1/20 0.31
CHRND Q07001 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.30
SOS1 Q07889 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
SCHEMBL28267059 0.75 MEN1 (0.37) GPR27NOTUMHPGD
SCHEMBL28268753 0.74 GPR27 (0.33) GPR27HPGDCHRNA1CHRNGCHRNB1
SCHEMBL20799563 0.72 MEN1 (0.39) GPR27POLBMAPTHPGDPTGDR2
SCHEMBL26607361 0.70 MEN1 (0.38) GPR27HPGDPTGDR2ALDH1A1
SCHEMBL6565291 0.70 KMT2A (0.57) GPR27HPGDPTGDR2ALDH1A1
SCHEMBL26601824 0.70 NOTUM (0.37) GPR27NOTUMMAPTMTORHPGD
SCHEMBL17244914 0.65 RAB9A (0.46) GPR27MTORHPGDCHRNA1CHRNG
SCHEMBL2796102 0.65 HSD17B10 (0.44) GPR27NOTUMHPGDALDH1A1
SCHEMBL28267060 0.65 STING1 (0.34) GPR27HPGDPTGDR2ALDH1A1
SCHEMBL18420521 0.64 NOTUM (0.45) GPR27NOTUMMAPTHPGDSLC6A3

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
CN-109096084-A It is a kind of using benzoyltrifluoroacetone derivative as the rare earth compounding and its preparation of ligand and luminous efficiency with higher and application 黑龙江大学 2018-12-28 CN disclosed