SCHEMBL4742525

SCHEMBL4742525

O=C(CCc1ccccc1)C(O)C(Nc1ccc(F)cc1)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 1/20 0.49
RECQL P46063 1/20 0.49
FFAR1 O14842 7/20 0.48
FFAR4 Q5NUL3 3/20 0.48
LMNA P02545 2/20 0.47
AR P10275 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
GAA P10253 1/20 0.46
POLB P06746 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
GPR34 Q9UPC5 1/20 0.44
LTA4H P09960 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL14068463 0.90 FFAR1 (0.52) MEN1KMT2AALDH1A1FFAR1FFAR4
SCHEMBL4745114 0.90 FFAR1 (0.52) MEN1KMT2AALDH1A1FFAR1FFAR4
SCHEMBL14068292 0.89 CXCL12 (0.47) MEN1KMT2AFFAR1LMNAGAA
SCHEMBL4745611 0.86 MEN1 (0.52) MEN1KMT2AALDH1A1RECQLFFAR1
SCHEMBL14068553 0.86 MEN1 (0.52) MEN1KMT2AALDH1A1RECQLFFAR1
SCHEMBL4744523 0.82 RAB9A (0.51) MEN1KMT2AALDH1A1FFAR1LMNA
SCHEMBL14068528 0.82 RAB9A (0.51) MEN1KMT2AALDH1A1FFAR1LMNA
SCHEMBL14261153 0.79 LTA4H (0.52) MEN1KMT2AALDH1A1RECQLFFAR1
SCHEMBL3418202 0.76 FFAR1 (0.57) MEN1KMT2AALDH1A1RECQLFFAR1
SCHEMBL3418207 0.76 FFAR1 (0.57) MEN1KMT2AALDH1A1RECQLFFAR1

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
WO-2008104875-A1 OXAZOLIDINONES AS CHOLESTEROL ABSORPTION INHIBITORS PFIZER PRODUCTS INC. (US) 2008-09-04 WO disclosed