SCHEMBL499885

SCHEMBL499885

O=C(O)CC(CC1CCCO1)N1CCOCC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.45
PKM P14618 2/20 0.40
ALDH1A1 P00352 6/20 0.38
KDM4E B2RXH2 6/20 0.37
HPGD P15428 3/20 0.37
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 1/20 0.36
MAPK1 P28482 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
ALOX12 P18054 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL15708977 0.76 NPSR1 (1.00) NPSR1L3MBTL1PKMALDH1A1POLB
SCHEMBL500617 0.74 NPSR1 (0.35) NPSR1L3MBTL1ALDH1A1HPGDSMN1; SMN2
SCHEMBL4438751 0.72 NPSR1 (0.45) NPSR1PKMALDH1A1HPGDUSP2
SCHEMBL500356 0.72 ALDH1A1 (0.44) NPSR1L3MBTL1ALDH1A1KDM4EHPGD
SCHEMBL499884 0.71 ALDH1A1 (0.45) NPSR1PKMALDH1A1KDM4EHPGD
SCHEMBL11864950 0.69 USP2 (0.49) NPSR1PKMALDH1A1KDM4EHPGD
SCHEMBL499960 0.67 POLB (0.40) NPSR1L3MBTL1ALDH1A1HPGDSMN1; SMN2
SCHEMBL1711900 0.66 USP2 (0.46) NPSR1PKMALDH1A1KDM4EHPGD
SCHEMBL1711904 0.66 USP2 (0.46) NPSR1PKMALDH1A1KDM4EHPGD
SCHEMBL1711899 0.66 USP2 (0.46) NPSR1PKMALDH1A1KDM4EHPGD

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
US-8105760-B2 Patterning process and pattern surface coating composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-01-31 US disclosed
US-20090053657-A1 PATTERNING PROCESS AND PATTERN SURFACE COATING COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2009-02-26 US disclosed