SCHEMBL6948209

SCHEMBL6948209

[O]C(=O)C(=O)N1CCSCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.41
PHGDH O43175 1/20 0.41
MGLL Q99685 1/20 0.41
HPGD P15428 3/20 0.39
ALDH1A1 P00352 1/20 0.39
HSD17B10 Q99714 1/20 0.39
DPP4 P27487 6/20 0.36
DPP8 Q6V1X1 2/20 0.36
DPP9 Q86TI2 2/20 0.36
DPP7 Q9UHL4 4/20 0.35
KCNH2 Q12809 1/20 0.35
KMT2A Q03164 1/20 0.35
AKR1C3 P42330 1/20 0.35
FDPS P14324 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 2/20 0.33
LIPE Q05469 1/20 0.32
NPC1 O15118 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32

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
SCHEMBL1832720 0.78
SCHEMBL4172003 0.77 ALDH1A1 (0.46) FAAHPHGDHMGLLHPGDALDH1A1
SCHEMBL15808681 0.77 FAAH (0.39) FAAHPHGDHMGLLHPGDALDH1A1
SCHEMBL20910881 0.75 AKR1C3 (0.52) FAAHPHGDHMGLLHPGDALDH1A1
SCHEMBL11314457 0.73 HPGD (0.40) FAAHPHGDHMGLLHPGDALDH1A1
SCHEMBL7442701 0.73 SMN1; SMN2 (0.46) HPGDDPP4KMT2AMAPTSMN1; SMN2
SCHEMBL1056953 0.73 CA2 (0.46) FAAHPHGDHMGLLHPGDALDH1A1
SCHEMBL337228 0.72
SCHEMBL983744 0.70
SCHEMBL429044 0.70

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-2003103652-A1 METHODS OF TREATING ALZHEIMER’S DISEASE USING AROMATICALLY SUBSTITUTED ω-AMINO-ALKANOIC ACID AMIDES AND ALKANOIC ACID DIAMIDES ELAN PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed