SCHEMBL8957417

SCHEMBL8957417

CCCCCCCC(CC)C(=O)Oc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.52
XBP1 P17861 1/20 0.52
ATM Q13315 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
LTA4H P09960 2/20 0.48
FAAH O00519 7/20 0.45
PRSS1 P07477 1/20 0.45
PRSS2 P07478 1/20 0.45
PRSS3 P35030 1/20 0.45
HDAC3 O15379 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CETP P11597 1/20 0.43
NPC1 O15118 1/20 0.42
HPGD P15428 1/20 0.42
CRHBP P24387 1/20 0.42
RAB9A P51151 1/20 0.42
CRHR2 Q13324 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
SCHEMBL2287185 0.94 ATM (0.53) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL28755162 0.94 ATM (0.53) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL2293325 0.94 ATM (0.53) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL28714996 0.94 ATM (0.53) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL2293709 0.93 L3MBTL1 (0.54) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL2294906 0.89 L3MBTL1 (0.59) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL29163411 0.89 ZDHHC2 (0.49) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL3929624 0.89 ZDHHC2 (0.49) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL11296486 0.89 ZDHHC2 (0.49) GAAXBP1ATMNPSR1L3MBTL1
SCHEMBL8208789 0.87 L3MBTL1 (0.58) GAAXBP1ATMNPSR1L3MBTL1

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
US-5512565-A REDUCE CHOLESTEROL ABSORPTION IN MAMMALS AMERICAN HOME PRODUCTS CORPORATION (US) 1996-04-30 US disclosed