SCHEMBL28056002

SCHEMBL28056002

C=CCP(=O)(Oc1ccccc1)OC1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
NPSR1 Q6W5P4 2/20 0.35
KLK8 O60259 1/20 0.35
PLAU P00749 1/20 0.35
KLK2 P20151 1/20 0.35
KLK4 Q9Y5K2 1/20 0.35
LMNA P02545 1/20 0.35
SRC P12931 1/20 0.34
DPP4 P27487 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
BTN3A1 O00481 1/20 0.33
RAB9A P51151 3/20 0.33
NPC1 O15118 2/20 0.33
MAPT P10636 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PKM P14618 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
SCHEMBL780979 0.80 SRC (0.47) MEN1KMT2AKLK8PLAUKLK2
SCHEMBL779830 0.80 ACHE (0.41) MEN1KMT2ANPSR1LMNA
SCHEMBL778196 0.78 DPP7 (0.36) DPP7MEN1KMT2ANPSR1KLK8
SCHEMBL3472688 0.76 ALDH1A1 (0.42) DPP7MEN1KMT2ANPSR1LMNA
SCHEMBL4458309 0.76 ALDH1A1 (0.42) DPP7MEN1KMT2ANPSR1LMNA
SCHEMBL777718 0.74 HRH3 (0.40) MEN1KMT2ALMNARAB9ANPC1
SCHEMBL11308363 0.74 BTN3A1 (0.51) MEN1KMT2ANPSR1KLK8PLAU
SCHEMBL8734790 0.74 SRC (0.46) MEN1KMT2AKLK8PLAUKLK2
SCHEMBL28611135 0.74 SRC (0.44) DPP7MEN1KMT2ANPSR1LMNA
SCHEMBL9114848 0.73 ACHE (0.36) RAB9ANPC1MAPTALDH1A1

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-103259044-B Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery MITSUBISHI CHEMICAL CORP. (JP) 2016-02-10 CN disclosed