SCHEMBL9717416

SCHEMBL9717416

O=C(NCCCO)c1cccc(C(=O)NCCCO)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.71
HSD17B10 Q99714 2/20 0.57
HPGD P15428 2/20 0.57
KDM4E B2RXH2 1/20 0.57
ALDH1A1 P00352 1/20 0.57
GAA P10253 1/20 0.53
KMT2A Q03164 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
HDAC3 O15379 1/20 0.53
HDAC4 P56524 1/20 0.53
HDAC1 Q13547 1/20 0.53
HDAC7 Q8WUI4 1/20 0.53
HDAC2 Q92769 1/20 0.53
HDAC10 Q969S8 1/20 0.53
HDAC11 Q96DB2 1/20 0.53
HDAC8 Q9BY41 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
HDAC9 Q9UKV0 1/20 0.53
HDAC5 Q9UQL6 1/20 0.53
LMNA P02545 1/20 0.53

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
SCHEMBL3319225 0.88 SMN1; SMN2 (0.65) SMN1; SMN2HSD17B10HPGDKDM4EALDH1A1
SCHEMBL14679386 0.88 NPC1 (0.64) SMN1; SMN2HSD17B10HPGDKDM4EALDH1A1
SCHEMBL2021484 0.86 NPC1 (0.68) SMN1; SMN2HSD17B10HPGDKDM4EALDH1A1
SCHEMBL3512125 0.84 POLB (0.72) SMN1; SMN2ALDH1A1HDAC3HDAC1HDAC2
SCHEMBL9717433 0.84 POLB (0.68) HSD17B10HPGDKDM4EALDH1A1L3MBTL1
SCHEMBL4909099 0.83 LMNA (0.72) SMN1; SMN2ALDH1A1KMT2AL3MBTL1HDAC1
SCHEMBL4595338 0.83 NAMPT (0.62) SMN1; SMN2HPGDKDM4EALDH1A1GAA
SCHEMBL7055005 0.83 NPC1 (0.62) SMN1; SMN2KDM4EALDH1A1GAAKMT2A
SCHEMBL16151772 0.83 SMN1; SMN2 (0.69) SMN1; SMN2HSD17B10KDM4EGAAKMT2A
SCHEMBL16117373 0.83 SMN1; SMN2 (1.00) SMN1; SMN2HSD17B10HPGDALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110146516-A1 METHOD OF PREPARING LITHOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2011-06-23 US disclosed
US-20110017084-A1 IMMERSION TYPE AUTOMATIC DEVELOPING APPARATUS FOR LITHOGRAPHIC PRINTING PLATE AND AUTOMATIC DEVELOPING METHOD FUJIFILM CORPORATION (JP) 2011-01-27 US disclosed
US-20110020757-A1 METHOD OF PREPARING LITHOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2011-01-27 US disclosed
US-5086104-A Mixture of thermoplastic resin, elastomer and amide compound, excellent toughtness, heat resistance and durability POLYPLASTICS CO., LTD. (JP) 1992-02-04 US disclosed
US-4687834-A Polyester imides and method for producing same HULS AKTIENGESELLSCHAFT (DE) 1987-08-18 US disclosed
US-4675211-A ONE POLAR SOLVENT BAYER AKTIENGESELLSCHAFT (DE) 1987-06-23 US disclosed