SCHEMBL28032465

SCHEMBL28032465

CCCCC1(NC(=O)OCc2ccccc2)CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 6/20 0.54
CTSL P07711 6/20 0.54
CTSB P07858 4/20 0.54
CTSK P43235 5/20 0.45
CETP P11597 4/20 0.44
ALDH1A1 P00352 2/20 0.44
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TLR2 O60603 2/20 0.43
HTT P42858 2/20 0.43
ADRB2 P07550 1/20 0.43
SLC10A2 Q12908 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42

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
SCHEMBL13512970 0.83 HTT (0.51) CTSSCTSLCTSBCTSKALDH1A1
SCHEMBL7121567 0.83 CTSS (0.56) CTSSCTSLCTSBCTSKALDH1A1
SCHEMBL17596481 0.82 CTSS (0.56) CTSSCTSLCTSBCTSKALDH1A1
SCHEMBL2722740 0.82 CTSS (0.55) CTSSCTSLCTSBCTSKALDH1A1
SCHEMBL4110578 0.82 CTSS (0.55) CTSSCTSLCTSBCTSKALDH1A1
SCHEMBL648487 0.81 CTSS (0.54) CTSSCTSLCTSBCTSKALDH1A1
SCHEMBL14977870 0.81 CA12 (0.46) CTSSCTSLCTSBALDH1A1TSHR
Hydrochloric Acid SCHEMBL8890541 0.81 CTSS (0.54) CTSSCTSLCTSBCTSKALDH1A1
SCHEMBL646194 0.81 CTSS (0.54) CTSSCTSLCTSBCTSKALDH1A1
SCHEMBL17595893 0.81 CTSS (0.54) CTSSCTSLCTSBCTSKALDH1A1

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-104950580-A Photosensitive polysiloxane composition and application thereof CHI MEI CORP 2015-09-30 CN disclosed