SCHEMBL28564927

SCHEMBL28564927

CC(C)(Oc1ccc2c(c1)OCO2)C(=O)Oc1ccc2c(c1)OCO2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.51
▸ GAA P10253 2/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ KMT2A Q03164 5/20 0.50
▸ ALOX15 P16050 4/20 0.49
▸ POLB P06746 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ TP53 P04637 1/20 0.49
▸ HPGD P15428 3/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ THRB P10828 1/20 0.47
▸ APEX1 P27695 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ ATM Q13315 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ MAPK1 P28482 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ GAPDH P04406 1/20 0.45
▸ TSHR P16473 5/20 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
Ammonia Solution, Strong SCHEMBL19469522 0.84 PPARA (0.49) LMNAGAAALDH1A1KMT2AALOX15
SCHEMBL10064132 0.81 KMT2A (0.51) LMNAGAAALDH1A1KMT2AALOX15
SCHEMBL1855445 0.81 LMNA (0.62) LMNAGAAALDH1A1KMT2AALOX15
SCHEMBL2733818 0.77 ALDH1A1 (0.51) LMNAGAAALDH1A1KMT2APOLB
SCHEMBL2900297 0.76 LMNA (0.60) LMNAGAAALDH1A1KMT2AALOX15
SCHEMBL27934725 0.75 ALDH1A1 (0.46) LMNAGAAALDH1A1KMT2AALOX15
SCHEMBL4758947 0.75 LMNA (0.65) LMNAGAAALDH1A1KMT2AALOX15
SCHEMBL27598271 0.74 LMNA (0.59) LMNAGAAALDH1A1KMT2AALOX15
SCHEMBL7074846 0.74 LMNA (0.60) LMNAGAAALDH1A1KMT2AALOX15
SCHEMBL10334579 0.74 ALDH1A1 (0.49) LMNAGAAALDH1A1KMT2AALOX15

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
CN-110407801-B 3, 4-methylenedioxy phenoxy fibrate- (3, 4-methylenedioxy) phenyl ester compound and application thereof in reducing blood fat 陕西中医药大学 2020-12-22 — — CN disclosed
Send feedback