SCHEMBL7561441

SCHEMBL7561441

CC1C(=O)c2ccccc2C(=O)C1S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC25A5 P05141 1/20 0.40
ALDH1A1 P00352 2/20 0.39
HBB P68871 2/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
S100A4 P26447 2/20 0.39
POLB P06746 2/20 0.39
MAPT P10636 5/20 0.36
CYP1A2 P05177 3/20 0.36
LMNA P02545 3/20 0.36
CYP3A4 P08684 2/20 0.36
MAPK1 P28482 2/20 0.36
TP53 P04637 2/20 0.36
HTR2B P41595 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
ALOX15 P16050 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
ALOX12 P18054 1/20 0.36

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
SCHEMBL1804432 0.84 MEN1 (0.44) SLC25A5ALDH1A1HBBHSD17B10MEN1
SCHEMBL15245116 0.76 MEN1 (0.55) ALDH1A1HBBHSD17B10MEN1KMT2A
SCHEMBL1804430 0.71 MEN1 (0.44) SLC25A5HBBMEN1KMT2AS100A4
SCHEMBL19130059 0.67 S100A4 (0.70) ALDH1A1HBBHSD17B10MEN1KMT2A
SCHEMBL677629 0.67 MEN1 (0.55) ALDH1A1HBBHSD17B10MEN1KMT2A
SCHEMBL11736969 0.66 RET (0.49) ALDH1A1HSD17B10MEN1KMT2AMAPT
SCHEMBL12646072 0.65 MEN1 (0.52) ALDH1A1HBBHSD17B10MEN1KMT2A
SCHEMBL23043831 0.64 MEN1 (0.50) SLC25A5ALDH1A1HBBHSD17B10MEN1
SCHEMBL22272424 0.64 MEN1 (0.50) SLC25A5ALDH1A1HBBHSD17B10MEN1
SCHEMBL822181 0.64 ACHE (0.42) SLC25A5ALDH1A1HBBHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010121638-A1 RECOVERY OF VITAMIN K3 FROM MOTHER LIQUOR LONZA LTD (CH) 2010-10-28 WO disclosed
EP-2243765-A1 Recovery of vitamin K3 mother liquor Lonza Ltd. (CH) 2010-10-27 EP disclosed
US-6488924-B1 MENADIONE BISULFITE SUPPORTED AND STABILIZED ON AN ION EXCHANGE RESIN; ANTIHEMORRHAGIC ADDITIVE FOR FISH FEED FORMULAS LUIGI STOPPANI S.P.A. (IT) 2002-12-03 US disclosed
EP-1185507-A1 VITAMIN K ADDUCT, PARTICULARLY SUITABLE AS VITAMIN SUPPLEMENT FOR FEEDS LUIGI STOPPANI S.p.A. (IT) 2002-03-13 EP disclosed
WO-2000078713-A1 VITAMIN K ADDUCT, PARTICULARLY SUITABLE AS VITAMIN SUPPLEMENT FOR FEEDS LUIGI STOPPANI S.P.A. (IT) 2000-12-28 WO disclosed