SCHEMBL9258477

SCHEMBL9258477

CC(C)(C)c1ccc2oc(C(=O)COc3ccc(C(=O)OCc4ccccc4)cc3)cc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.46
LMNA P02545 4/20 0.46
HPGD P15428 3/20 0.46
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HDAC6 Q9UBN7 1/20 0.45
KMT2A Q03164 5/20 0.43
POLB P06746 5/20 0.43
MEN1 O00255 3/20 0.43
GAA P10253 1/20 0.43
CYP2C19 P33261 1/20 0.43
NR4A2 P43354 1/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
ALDH1A1 P00352 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
ADRB3 P13945 1/20 0.42

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
SCHEMBL9251832 0.86 HDAC6 (0.49) MAPTLMNAHPGDRAB9ANPC1
SCHEMBL9257649 0.86 RXRA (0.52) MAPTLMNAHPGDRAB9ANPC1
SCHEMBL9260302 0.85 NPC1 (0.48) MAPTLMNAHPGDRAB9ANPC1
SCHEMBL9263275 0.80 NPC1 (0.48) MAPTLMNAHPGDRAB9ANPC1
SCHEMBL18320469 0.75 KMT2A (0.69) MAPTLMNAHPGDRAB9ANPC1
SCHEMBL15714290 0.74 PIM1 (0.63) MAPTLMNAKMT2ATDP1SLC6A2
SCHEMBL6984136 0.74 POLB (0.51) MAPTLMNAHPGDRAB9ANPC1
SCHEMBL8717367 0.74 KMT2A (0.55) MAPTLMNAHPGDRAB9ANPC1
SCHEMBL9787056 0.74 KMT2A (0.68) MAPTLMNAHPGDRAB9ANPC1
SCHEMBL8712740 0.73 KMT2A (0.54) MAPTLMNAHPGDRAB9ANPC1

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-5432195-A Anticholesterol NIPPON SHINYAKU COMPANY LIMITED (JP) 1995-07-11 US disclosed
EP-0601181-A1 BENZOFURAN DERIVATIVE AND PHARMACEUTICAL COMPOSITION NIPPON SHINYAKU COMPANY, LIMITED (JP) 1994-06-15 EP disclosed