SCHEMBL7646202

SCHEMBL7646202

COC(=O)c1ccccc1COC(=O)OCc1ccccc1C(=O)OC

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.63
LMNA P02545 4/20 0.63
KMT2A Q03164 1/20 0.53
TSHR P16473 1/20 0.52
HSD17B10 Q99714 4/20 0.50
CFTR P13569 1/20 0.50
KDM4E B2RXH2 4/20 0.49
HTT P42858 2/20 0.49
HIF1A Q16665 1/20 0.49
POLB P06746 2/20 0.49
ATM Q13315 1/20 0.49
GAA P10253 1/20 0.47
MAPK8 P45983 1/20 0.47
MAPK9 P45984 1/20 0.47
MAPK10 P53779 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C19 P33261 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
GLA P06280 1/20 0.46

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
SCHEMBL7646204 0.88 ALDH1A1 (0.57) ALDH1A1LMNAKMT2ATSHRHSD17B10
SCHEMBL6670592 0.88 ALDH1A1 (0.61) ALDH1A1LMNAKMT2ATSHRHSD17B10
SCHEMBL5914676 0.86 ALDH1A1 (0.55) ALDH1A1LMNAKMT2ATSHRHSD17B10
SCHEMBL6668857 0.86 ALDH1A1 (0.59) ALDH1A1LMNAKMT2ATSHRHSD17B10
SCHEMBL3150175 0.85 ALDH1A1 (0.62) ALDH1A1LMNAKMT2ATSHRHSD17B10
SCHEMBL6669086 0.85 ALDH1A1 (0.62) ALDH1A1LMNAKMT2ATSHRHSD17B10
SCHEMBL6441720 0.84 TSHR (0.67) ALDH1A1LMNATSHRHSD17B10KDM4E
SCHEMBL70322 0.81 ALDH1A1 (0.66) ALDH1A1LMNAKMT2ATSHRHSD17B10
SCHEMBL10360804 0.81 ALDH1A1 (0.77) ALDH1A1LMNAKMT2ATSHRHSD17B10
SCHEMBL156281 0.81 ALDH1A1 (0.66) ALDH1A1LMNAKMT2ATSHRHSD17B10

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-6410777-B1 HALOGEN-FREE TEIJIN LIMITED (JP) 2002-06-25 US disclosed
EP-0980861-A1 SALICYLIC ESTER DERIVATIVES AND PROCESS FOR PRODUCING THE SAME TEIJIN LIMITED (JP) 2000-02-23 EP disclosed