SCHEMBL8675401

SCHEMBL8675401

c1ccc(COc2ccc(OCCOCOCCOc3ccc(OCc4ccccc4)cc3)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.60
CYP1A2 P05177 1/20 0.60
PTGS1 P23219 1/20 0.60
SLC6A2 P23975 1/20 0.60
CYP2C19 P33261 1/20 0.60
PTGS2 P35354 1/20 0.60
SLC6A3 Q01959 1/20 0.60
HIF1A Q16665 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60
MAOB P27338 3/20 0.58
RAB9A P51151 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
GAA P10253 1/20 0.58
MAPT P10636 1/20 0.58
MAOA P21397 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
FOXM1 Q08050 1/20 0.56
NPC1 O15118 1/20 0.55
TP53 P04637 1/20 0.55
BCHE P06276 1/20 0.55

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
SCHEMBL6852321 0.92 LMNA (0.64) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL5677947 0.90 LMNA (0.62) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL9808056 0.90 LMNA (0.72) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL321345 0.85 CHRNA7 (0.59) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL10795544 0.85 FOXM1 (0.57) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL16594362 0.84 TSHR (0.56) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL29045829 0.84 MAOB (0.59) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL29045776 0.84 LMNA (0.59) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL20425463 0.84 RAB9A (0.58) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL320403 0.84 CHRNA7 (0.58) LMNACYP1A2PTGS1SLC6A2CYP2C19

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-5827796-A Thermal recording material FUJI PHOTO FILM CO., LTD. (JP) 1998-10-27 US disclosed