SCHEMBL4736146

SCHEMBL4736146

CCCOC(=O)c1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.86
ALDH1A1 P00352 8/20 0.66
TSHR P16473 3/20 0.66
TDP1 Q9NUW8 2/20 0.66
ESR1 P03372 2/20 0.66
CHRM1 P11229 1/20 0.66
SLC6A2 P23975 1/20 0.66
KDR P35968 1/20 0.66
MAPT P10636 3/20 0.58
HPGD P15428 3/20 0.58
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.58
THRB P10828 1/20 0.58
STS P08842 1/20 0.54
CYP1A2 P05177 2/20 0.53
CYP2C19 P33261 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
MAPK1 P28482 2/20 0.53
CYP2D6 P10635 1/20 0.53
NR1H2 P55055 1/20 0.53

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
SCHEMBL7181498 0.93 LMNA (1.00) LMNAALDH1A1TSHRTDP1ESR1
SCHEMBL130761 0.93 LMNA (1.00) LMNAALDH1A1TSHRTDP1ESR1
SCHEMBL15315055 0.91 LMNA (0.71) LMNAALDH1A1TSHRTDP1ESR1
Hydrochloric Acid SCHEMBL27605432 0.91 LMNA (0.96) LMNAALDH1A1TSHRTDP1ESR1
SCHEMBL30886680 0.91 LMNA (0.96) LMNAALDH1A1TSHRTDP1ESR1
Methane SCHEMBL28760616 0.91 LMNA (0.96) LMNAALDH1A1TSHRTDP1ESR1
SCHEMBL28387455 0.91 LMNA (0.96) LMNAALDH1A1TSHRTDP1ESR1
Methyl Alcohol SCHEMBL28069166 0.91 LMNA (0.96) LMNAALDH1A1TSHRTDP1ESR1
SCHEMBL4465574 0.91 LMNA (0.96) LMNAALDH1A1TSHRTDP1ESR1
Water SCHEMBL28012190 0.91 LMNA (0.96) LMNAALDH1A1TSHRTDP1ESR1

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-4080275-A POLYMERIZATION INITIATOR, ETHYLENICALLY UNSATURATED MONOMER STAUFFER CHEMICAL COMPANY (US) 1978-03-21 US claimed
WO-2008060844-A1 POLYMERIZATION INHIBITOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE ALBEMARLE CORPORATION (US) 2008-05-22 WO disclosed