SCHEMBL1995983

SCHEMBL1995983

CCCCc1ccc(-c2c(OPO)cccc2-c2ccccc2)c(CCCC)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 1/20 0.42
TLR8 Q9NR97 1/20 0.38
GPR3 P46089 1/20 0.38
ELANE P08246 2/20 0.37
CTSG P08311 1/20 0.37
MAPK8 P45983 1/20 0.36
HTT P42858 2/20 0.35
APAF1 O14727 1/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
MAPK1 P28482 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
BCL2L2 Q92843 1/20 0.34
HSD11B1 P28845 1/20 0.34
KDM4E B2RXH2 1/20 0.34
PTGER1 P34995 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
SCHEMBL1904401 0.88 PSMB5 (0.40) PSMB5GPR3MAPK8HTTAPAF1
SCHEMBL1997519 0.83 ALOX5 (0.39) PSMB5TLR8ELANECTSGTHRB
SCHEMBL29791084 0.79 MAPK8 (0.38) PSMB5GPR3MAPK8HTTAPAF1
SCHEMBL1880866 0.77 RARB (0.40) TLR8MAPTMEN1KMT2AHSD11B1
SCHEMBL27836085 0.76 PSMB5 (0.51) PSMB5TLR8GPR3HTTAPAF1
SCHEMBL1881872 0.76 ELANE (0.33) ELANECTSGHTTMAPK1NPC1
SCHEMBL500197 0.75 ELANE (0.36) ELANECTSGTHRB
SCHEMBL1887036 0.75 GPR3 (0.41) GPR3
SCHEMBL27836086 0.75 PSMB5 (0.52) PSMB5TLR8GPR3HTTAPAF1
SCHEMBL28922492 0.75 GPR3 (0.53) PSMB5TLR8GPR3ELANECTSG

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8969436-B2 Method of producing a molded article TEIJIN CHEMICALS, LTD. (JP) 2015-03-03 US disclosed
US-20110147992-A1 METHOD OF PRODUCING A MOLDED ARTICLE TEIJIN CHEMICALS, LTD. (JP) 2011-06-23 US disclosed