SCHEMBL538589

SCHEMBL538589

CCCCCN1CCC(C(C)(C)CC(C)(C)C)CCC1=O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.43
NPC1 O15118 4/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.39
GFER P55789 1/20 0.38
FAAH O00519 1/20 0.33
MGLL Q99685 1/20 0.33
GBA1 P04062 1/20 0.33
CNR2 P34972 1/20 0.33
ALOX5 P09917 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL4017035 0.72 MGLL (0.47) RAB9ANPC1FAAHMGLLGBA1
SCHEMBL867809 0.70 NPC1 (0.32) RAB9ANPC1MEN1KMT2AL3MBTL1
SCHEMBL31601950 0.70 MGLL (0.50) RAB9ANPC1FAAHMGLLGBA1
SCHEMBL31601927 0.70 MGLL (0.50) RAB9ANPC1FAAHMGLLGBA1
SCHEMBL31602002 0.70 MGLL (0.50) RAB9ANPC1FAAHMGLLGBA1
SCHEMBL31602099 0.70 MGLL (0.50) RAB9ANPC1FAAHMGLLGBA1
SCHEMBL31602082 0.70 MGLL (0.50) RAB9ANPC1FAAHMGLLGBA1
SCHEMBL20441233 0.70 MGLL (0.50) RAB9ANPC1FAAHMGLLGBA1
SCHEMBL31601873 0.70 MGLL (0.50) RAB9ANPC1FAAHMGLLGBA1
SCHEMBL31602133 0.70 MGLL (0.50) RAB9ANPC1FAAHMGLLGBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2414409-A1 POLYMERS HAVING N-VINYL AMIDE AND HYDROXYL MOIETIES Isp Investments Inc. (US) 2012-02-08 EP claimed
WO-2010117660-A1 POLYMERS HAVING N-VINYL AMIDE AND HYDROXYL MOIETIES ISP INVESTMENTS INC. (US) 2010-10-14 WO claimed