SCHEMBL3398188

SCHEMBL3398188

CCCC(CC(=O)O)C(CC)C(=O)OC(=O)C(CC)C(CCC)CC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.39
CHRM1 P11229 1/20 0.39
AKR1A1 P14550 1/20 0.39
CHRM3 P20309 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
ADRA1A P35348 1/20 0.39
HRH1 P35367 1/20 0.39
DRD3 P35462 1/20 0.39
SLC6A3 Q01959 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
GPR84 Q9NQS5 4/20 0.35
FFAR3 O14843 1/20 0.32
CA2 P00918 2/20 0.32
CA1 P00915 1/20 0.32
MAPK1 P28482 1/20 0.31
ZDHHC7 Q9NXF8 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL6049840 0.82 TDP1 (0.48) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL5079726 0.77 HDAC1 (0.48) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL5079729 0.77 HDAC1 (0.48) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL21628119 0.76 TDP1 (0.48) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL13403131 0.76 HDAC1 (0.42) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL8957753 0.72 CA2 (0.48) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL5516785 0.71 HDAC1 (0.42) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL11862679 0.71 CA1 (0.47) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL30049090 0.71 POLB (0.40) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL2327830 0.71 METAP1 (0.41) TDP1CHRM1AKR1A1CHRM3HTR2A

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
US-8084530-B2 Sealing agent for optical semiconductor element, and optical semiconductor element SEKISUI CHEMICAL CO., LTD. (JP) 2011-12-27 US disclosed
US-20100171414-A1 SEALING AGENT FOR OPTICAL SEMICONDUCTOR ELEMENT, AND OPTICAL SEMICONDUCTOR ELEMENT SEKISUI CHEMICAL CO., LTD. (JP) 2010-07-08 US disclosed
EP-2159242-A1 SEALING AGENT FOR OPTICAL SEMICONDUCTOR ELEMENT, AND OPTICAL SEMICONDUCTOR ELEMENT Sekisui Chemical Co., Ltd. (JP) 2010-03-03 EP disclosed
US-20090091045-A1 Themosetting Composition for Optical Semiconductor, Die Bond Material for Optical Semiconductor Device, Underfill Material for Optical Semiconductor Device, Sealing Agent for Optical Semiconductor Device, and Optical Semiconductor Device SEKISUI CHEMICAL CO., LTD 2009-04-09 US disclosed
EP-2017295-A1 THERMOSETTING COMPOSITION FOR OPTICAL SEMICONDUCTOR, DIE BOND MATERIAL FOR OPTICAL SEMICONDUCTOR DEVICE, UNDERFILL MATERIAL FOR OPTICAL SEMICONDUCTOR DEVICE, SEALING AGENT FOR OPTICAL SEMICONDUCTOR DEVICE, AND OPTICAL SEMICONDUCTOR DEVICE Sekisui Chemical Co., Ltd. (JP) 2009-01-21 EP disclosed