SCHEMBL7639705

SCHEMBL7639705

CCCC(OC(=O)OC(CCC)c1ccccc1C(=O)OC)c1ccccc1C(=O)OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
TSHR P16473 1/20 0.44
ALDH1A1 P00352 6/20 0.42
HSD17B10 Q99714 3/20 0.42
CFTR P13569 1/20 0.42
KMT2A Q03164 3/20 0.42
KDM4E B2RXH2 6/20 0.41
POLB P06746 2/20 0.41
ATM Q13315 2/20 0.41
GAA P10253 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GLA P06280 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA5A P35218 1/20 0.39
CA9 Q16790 1/20 0.39
MAPT P10636 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL6472205 0.92 CYP1A2 (0.45) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL7643004 0.90 ALDH1A1 (0.47) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL6436469 0.89 ALDH1A1 (0.49) LMNATSHRALDH1A1HSD17B10KMT2A
SCHEMBL7643422 0.89 ALDH1A1 (0.49) LMNATSHRALDH1A1HSD17B10KMT2A
SCHEMBL7200254 0.89 ALDH1A1 (0.49) LMNATSHRALDH1A1HSD17B10KMT2A
SCHEMBL27491579 0.83 TSHR (0.48) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL6472214 0.82 ALDH1A1 (0.44) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL22358672 0.80 LMNA (0.47) LMNATSHRALDH1A1HSD17B10CFTR
SCHEMBL6436479 0.80 ALDH1A1 (0.51) LMNATSHRALDH1A1HSD17B10KMT2A
SCHEMBL6467391 0.79 TSHR (0.53) LMNATSHRALDH1A1HSD17B10KDM4E

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