SCHEMBL30801508

SCHEMBL30801508

CC=Cc1cccc(OCCCC)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 2/20 0.67
TLR2 O60603 2/20 0.67
AHR P35869 1/20 0.50
TSHR P16473 1/20 0.49
ALDH1A1 P00352 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
HTT P42858 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
KDM4E B2RXH2 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
LTA4H P09960 2/20 0.47
CHRNA7 P36544 1/20 0.47
LCK P06239 1/20 0.45
RELA Q04206 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP19A1 P11511 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL3210547 0.86 TLR4 (0.61) TLR4TLR2AHRTSHRSMN1; SMN2
SCHEMBL28733922 0.86 TLR4 (0.51) TLR4TLR2TSHRALDH1A1LMNA
SCHEMBL17864841 0.85 TLR4 (0.65) TLR4TLR2AHRTSHRALDH1A1
SCHEMBL22551251 0.84 TLR4 (0.63) TLR4TLR2AHRTSHRALDH1A1
SCHEMBL22563300 0.84 TLR4 (0.63) TLR4TLR2AHRTSHRALDH1A1
SCHEMBL22551252 0.84 TLR4 (0.63) TLR4TLR2AHRTSHRALDH1A1
SCHEMBL23366653 0.83 TLR4 (0.48) TLR4TLR2ALDH1A1LMNAMAPT
SCHEMBL30230160 0.83 TAAR1 (0.48) TLR4TLR2ALDH1A1LMNAMAPT
SCHEMBL27852699 0.83 TLR4 (0.48) TLR4TLR2ALDH1A1LMNAMAPT
SCHEMBL15026227 0.83 TLR4 (0.55) TLR4TLR2AHRTSHRALDH1A1

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-117720787-A Flexible metal clad laminate and method of making the same 科腾聚合物荷兰有限责任公司 2024-03-19 CN disclosed