SCHEMBL7762452

SCHEMBL7762452

O=C(OCCO)c1cccc(C(=O)OCCOC(=O)c2ccc(C(=O)OCCOC(=O)c3cccc(C(=O)OCCO)c3)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.56
TDP1 Q9NUW8 2/20 0.53
CYP4F2 P78329 3/20 0.50
CYP4A11 Q02928 3/20 0.50
LMNA P02545 2/20 0.50
SERPINE1 P05121 2/20 0.49
ESR1 P03372 2/20 0.47
ESR2 Q92731 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 2/20 0.46
TSHR P16473 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CHRM1 P11229 1/20 0.44
SLC6A2 P23975 1/20 0.44
KDR P35968 1/20 0.44

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
SCHEMBL6736568 0.96 SLC7A5 (0.59) SLC7A5TDP1CYP4F2CYP4A11LMNA
SCHEMBL134602 0.94 SLC7A5 (0.60) SLC7A5TDP1CYP4F2CYP4A11LMNA
SCHEMBL27677451 0.93 TDP1 (0.56) SLC7A5TDP1CYP4F2CYP4A11LMNA
SCHEMBL29404963 0.92 SLC7A5 (0.59) SLC7A5TDP1CYP4F2CYP4A11LMNA
SCHEMBL6537065 0.92 SLC7A5 (0.59) SLC7A5TDP1CYP4F2CYP4A11LMNA
Terephthalic Acid SCHEMBL28791250 0.89 SLC7A5 (0.57) SLC7A5TDP1CYP4F2CYP4A11LMNA
SCHEMBL18616298 0.89 TDP1 (0.68) SLC7A5TDP1LMNAESR1ESR2
SCHEMBL13292517 0.88 TDP1 (0.54) SLC7A5TDP1CYP4A11LMNASERPINE1
SCHEMBL19235060 0.88 TDP1 (0.54) SLC7A5TDP1CYP4A11LMNASERPINE1
SCHEMBL26453328 0.88 TDP1 (0.54) SLC7A5TDP1CYP4A11LMNASERPINE1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0665462-B1 Thermofixable photosensitive recording material and process for preparing thereof NEW OJI PAPER CO LTD (JP) 2001-04-18 EP disclosed
US-5565306-A SUBSTRATE HAVING RECORDING LAYER CONTAINING PYRAZOLONE DERIVATIVE, HYDROQUINONE DERIVATIVE, ACIDIC SUBSTANCE MUTUALLY DISSOLVED THEREIN NEW OJI PAPER CO., LTD. (JP) 1996-10-15 US disclosed
EP-0665462-A1 Thermofixable photosensitive recording material and process for preparing thereof NEW OJI PAPER CO., LTD. (JP) 1995-08-02 EP disclosed