SCHEMBL8630653

SCHEMBL8630653

Cc1oc(Cl)cc1C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 3/20 0.57
NPC1 O15118 4/20 0.56
RAB9A P51151 4/20 0.56
MAPT P10636 2/20 0.52
APEX1 P27695 3/20 0.49
GLA P06280 1/20 0.47
ALDH1A1 P00352 5/20 0.42
HSD17B10 Q99714 4/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
KDM4E B2RXH2 2/20 0.42
MAPK1 P28482 2/20 0.42
POLB P06746 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
HPGD P15428 2/20 0.41
TP53 P04637 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MEN1 O00255 1/20 0.41
ALOX15 P16050 1/20 0.41
LIG1 P18858 1/20 0.41

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
SCHEMBL3055063 0.84 MAPT (0.42) TTRNPC1RAB9AMAPTAPEX1
SCHEMBL7840069 0.78 ALDH1A1 (0.46) MAPTALDH1A1KDM4EPOLBL3MBTL1
SCHEMBL546834 0.77 MAPT (0.59) TTRNPC1RAB9AMAPTAPEX1
Hydrochloric Acid SCHEMBL3043164 0.76 MAPT (0.57) TTRNPC1RAB9AMAPTAPEX1
SCHEMBL20419124 0.75 TTR (0.65) TTRNPC1RAB9AMAPTAPEX1
SCHEMBL8629493 0.75 TSHR (0.48) MAPTALDH1A1SMN1; SMN2MAPK1L3MBTL1
SCHEMBL3972401 0.74 TTR (0.52) TTRNPC1RAB9AMAPTAPEX1
SCHEMBL18322316 0.74 TTR (1.00) TTRNPC1RAB9AMAPTAPEX1
SCHEMBL18322309 0.74 TTR (1.00) TTRNPC1RAB9AMAPTAPEX1
SCHEMBL2162290 0.74 TTR (0.66) TTRNPC1RAB9AMAPTAPEX1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5840917-A ADMINISTERING TO MAMMAL TO ERADICATE HELICOBACTER PYLORI TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-11-24 US disclosed
WO-1998042347-A1 PHARMACEUTICAL COMPOSITION CONTAINING A PHOSPHORYLAMIDE AND AN AYNTIBIOTIC TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-10-01 WO disclosed
EP-0852498-A1 PHOSPHORYLAMIDES, THEIR PREPARATION AND USE Takeda Chemical Industries, Ltd. (JP) 1998-07-15 EP disclosed
WO-1997011705-A1 PHOSPHORYLAMIDES, THEIR PREPARATION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-04-03 WO disclosed