SCHEMBL10329655

SCHEMBL10329655

C=CC(=O)OCC(O)COCC1CCCO1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
POLB P06746 1/20 0.43
PRMT5 O14744 1/20 0.42
WDR77 Q9BQA1 1/20 0.42
ALDH1A1 P00352 2/20 0.42
DRD2 P14416 1/20 0.40
HTR2A P28223 1/20 0.40
HRH1 P35367 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TSHR P16473 1/20 0.37
KDM4E B2RXH2 2/20 0.36
ADRB2 P07550 1/20 0.36
MAPK1 P28482 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MGLL Q99685 1/20 0.35
HPGD P15428 1/20 0.34

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
SCHEMBL25673993 0.86 TSHR (0.43) LMNAPOLBPRMT5WDR77ALDH1A1
SCHEMBL3051768 0.85 TSHR (0.40) LMNAPOLBALDH1A1NPSR1TSHR
SCHEMBL9242015 0.85 TSHR (0.42) ALDH1A1TSHRMAPK1MGLLHPGD
SCHEMBL671634 0.83 TSHR (0.41) ALDH1A1TSHRMAPK1MGLLHPGD
SCHEMBL26837 0.81 LMNA (0.58) LMNAPOLBALDH1A1NPSR1MGLL
SCHEMBL233284 0.81 TSHR (0.51) LMNAPOLBALDH1A1NPSR1TSHR
SCHEMBL27578081 0.80 LMNA (0.57) LMNAPOLBALDH1A1NPSR1MGLL
Ethylene SCHEMBL10688183 0.80 LMNA (0.57) LMNAPOLBALDH1A1NPSR1MGLL
SCHEMBL12429071 0.80 LMNA (0.50) LMNAPOLBALDH1A1NPSR1TSHR
SCHEMBL12430294 0.80 TSHR (0.50) LMNAPOLBALDH1A1TSHRMGLL

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
WO-2021132924-A1 ENCAPSULATION COMPOSITION, ENCAPSULATION LAYER COMPRISING SAME, AND ENCAPSULATED APPARATUS COMPRISING ENCAPSULATION LAYER 솔루스첨단소재 주식회사 2021-07-01 WO disclosed
EP-2159272-B1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORP (JP) 2017-09-27 EP disclosed
US-8220912-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2012-07-17 US disclosed
US-8220912-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2012-07-17 US disclosed
US-20100053290-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2010-03-04 US disclosed
US-20100053290-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2010-03-04 US disclosed