SCHEMBL6067577

SCHEMBL6067577

C=COCCOC(=O)c1ccc(C(=O)OCCOC=C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.47
TSHR P16473 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
ALDH1A1 P00352 2/20 0.47
CHRM1 P11229 1/20 0.47
SLC6A2 P23975 1/20 0.47
KDR P35968 1/20 0.47
ESR2 Q92731 2/20 0.46
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
LMNA P02545 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
CYP2D6 P10635 1/20 0.44
MAPK1 P28482 1/20 0.44
NR1H2 P55055 1/20 0.44
RNASEL Q05823 1/20 0.44
CYP3A4 P08684 2/20 0.43
CYP2C9 P11712 1/20 0.43

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
SCHEMBL8385248 0.93 ESR1 (0.59) ESR1TSHRTDP1ALDH1A1CHRM1
SCHEMBL10773147 0.93 TDP1 (0.46) ESR1TSHRTDP1ALDH1A1CHRM1
SCHEMBL12376808 0.91 ESR1 (0.41) ESR1TSHRTDP1ALDH1A1CHRM1
SCHEMBL13567324 0.91 RAB9A (0.47) ESR1TSHRTDP1ALDH1A1CHRM1
SCHEMBL2978166 0.91 TDP1 (0.61) ESR1TSHRTDP1ALDH1A1SLC6A2
SCHEMBL15865003 0.89 TDP1 (0.53) ESR1TSHRTDP1ALDH1A1CHRM1
SCHEMBL1131138 0.89 TDP1 (0.58) ESR1TSHRTDP1ALDH1A1CHRM1
SCHEMBL14803622 0.88 KDM4E (0.54) ESR1TDP1ALDH1A1ESR2NPC1
SCHEMBL276085 0.88 SERPINE1 (0.52) ESR1TDP1SERPINE1CA12CA1
SCHEMBL14818787 0.87 TDP1 (0.46) TDP1ALDH1A1NPC1RAB9ALMNA

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-7101649-B2 Heat-sensitive lithographic printing plate FUJI PHOTO FILM CO., LTD. (JP) 2006-09-05 US disclosed