SCHEMBL11450666

SCHEMBL11450666

Cc1ccc(C(=O)CO[C]=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.53
RAB9A P51151 5/20 0.53
ALDH1A1 P00352 3/20 0.53
MAPT P10636 2/20 0.53
GSK3B P49841 1/20 0.52
KMT2A Q03164 4/20 0.49
MEN1 O00255 1/20 0.48
LMNA P02545 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TP53 P04637 1/20 0.46
HPGD P15428 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
POLB P06746 1/20 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
SCHEMBL773970 0.81 HDAC3 (0.58) NPC1RAB9AALDH1A1MAPTGSK3B
SCHEMBL10465722 0.81 GSK3B (0.53) NPC1RAB9AALDH1A1MAPTGSK3B
SCHEMBL11074836 0.81 GSK3B (0.53) NPC1RAB9AALDH1A1MAPTGSK3B
SCHEMBL1282 0.80 MAPT (0.52) NPC1RAB9AALDH1A1MAPTGSK3B
SCHEMBL11806422 0.79 NPC1 (0.59) NPC1RAB9AALDH1A1MAPTGSK3B
SCHEMBL2064455 0.78 NPC1 (0.58) NPC1RAB9AALDH1A1MAPTGSK3B
SCHEMBL3641682 0.78 GSK3B (0.57) NPC1RAB9AALDH1A1MAPTGSK3B
SCHEMBL13606921 0.74 NPC1 (0.54) NPC1RAB9AALDH1A1MAPTGSK3B
SCHEMBL4549475 0.74 RAB9A (0.64) NPC1RAB9AALDH1A1MAPTGSK3B
SCHEMBL17702639 0.73 NPC1 (0.53) NPC1RAB9AALDH1A1MAPTGSK3B

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-4214094-A ANTILIPEMIC AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-07-22 US disclosed