SCHEMBL5308792

SCHEMBL5308792

C#CC(C)(C)Oc1ccc(C(=O)c2ccc(O)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 9/20 0.57
LMNA P02545 3/20 0.48
MAPT P10636 3/20 0.48
HTT P42858 2/20 0.48
HPGD P15428 2/20 0.48
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48
PKM P14618 1/20 0.48
PPARG P37231 3/20 0.45
PPARA Q07869 2/20 0.45
FABP2 P12104 1/20 0.45
SLC22A12 Q96S37 1/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
KDM4E B2RXH2 1/20 0.44
SRD5A2 P31213 1/20 0.43
MAPK1 P28482 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
USP2 O75604 1/20 0.40
ABCB11 O95342 1/20 0.40

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
SCHEMBL21408547 0.88 MEN1 (0.48) ELANELMNAHPGDESR1ESR2
SCHEMBL5308495 0.87 ELANE (0.55) ELANEPPARGPPARAFABP2SLC22A12
SCHEMBL3418004 0.81 ELANE (0.66) ELANELMNAMAPTHTTHPGD
SCHEMBL14139184 0.79 ELANE (0.62) ELANEMAPTMEN1KMT2AKDM4E
SCHEMBL29038424 0.77 ELANE (0.49) ELANELMNAMAPTPPARGPPARA
Fenofibrate Acid SCHEMBL22373737 0.77 PPARG (0.73) ELANELMNAMAPTHTTHPGD
SCHEMBL7940897 0.74 LMNA (0.58) ELANELMNAMAPTHTTHPGD
SCHEMBL5541822 0.74 ESR1 (0.58) ELANELMNAMAPTHTTHPGD
SCHEMBL20076975 0.73 ELANE (0.60) ELANELMNAMAPTHPGDPPARG
SCHEMBL4406876 0.73 ELANE (1.00) ELANELMNAMAPTHTTHPGD

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
WO-2007039609-A1 PYRANODIBENZOFURAN DERIVATIVES WITH ANTIFUNGAL AND ANTIBACTERIAL ACTIVITY INSTITUT PASTEUR (FR) 2007-04-12 WO disclosed