SCHEMBL19930205

SCHEMBL19930205

C=CC(=O)OCOc1ccc(C(=O)Oc2ccc(CCc3ccc(OCCCCCC)cc3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.56
NPC1 O15118 3/20 0.55
LMNA P02545 3/20 0.55
NFKB1 P19838 3/20 0.55
NFKB2 Q00653 3/20 0.55
RELA Q04206 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
MAPT P10636 4/20 0.48
POLB P06746 1/20 0.48
PRSS1 P07477 1/20 0.47
ACR P10323 1/20 0.47
TP53 P04637 1/20 0.47
TSHR P16473 1/20 0.47
KMT2A Q03164 3/20 0.46
PLA2G4B P0C869 1/20 0.46

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
SCHEMBL19930193 1.00 THRB (0.56) THRBNPC1LMNANFKB1NFKB2
SCHEMBL19930191 0.95 THRB (0.64) THRBNPC1LMNANFKB1NFKB2
SCHEMBL19930180 0.94 NPC1 (0.60) THRBNPC1LMNANFKB1NFKB2
SCHEMBL12404404 0.94 NPC1 (0.60) THRBNPC1LMNANFKB1NFKB2
SCHEMBL19930185 0.94 NPC1 (0.60) THRBNPC1LMNANFKB1NFKB2
SCHEMBL16425370 0.94 NPC1 (0.60) THRBNPC1LMNANFKB1NFKB2
SCHEMBL17279041 0.94 THRB (0.58) THRBNPC1LMNANFKB1NFKB2
SCHEMBL17279042 0.94 THRB (0.58) THRBNPC1LMNANFKB1NFKB2
SCHEMBL17279037 0.94 THRB (0.58) THRBNPC1LMNANFKB1NFKB2
SCHEMBL17279040 0.94 THRB (0.58) THRBNPC1LMNANFKB1NFKB2

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
US-20180067348-A1 POLARIZING PLATE AND CIRCULARLY POLARIZING PLATE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-03-08 US disclosed