SCHEMBL17205648

SCHEMBL17205648

COc1ccccc1OCCCC=C(O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.54
POLB P06746 1/20 0.53
L3MBTL1 Q9Y468 3/20 0.50
MAPT P10636 1/20 0.50
MTNR1A P48039 1/20 0.50
MTNR1B P49286 1/20 0.50
NPSR1 Q6W5P4 2/20 0.49
TDP1 Q9NUW8 3/20 0.48
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 3/20 0.47
HTR1A P08908 2/20 0.47
ADRA1D P25100 2/20 0.47
ADRA1A P35348 2/20 0.47
ADRA1B P35368 2/20 0.47
NPC1 O15118 1/20 0.46
CYP2C9 P11712 1/20 0.46
RAB9A P51151 1/20 0.46
RXRA P19793 1/20 0.46
CA12 O43570 1/20 0.44

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
SCHEMBL17205376 0.85 TDP1 (0.54) SMN1; SMN2L3MBTL1MAPTNPSR1TDP1
SCHEMBL1535474 0.81 KDM4E (0.57) LMNASMN1; SMN2POLBL3MBTL1KDM4E
SCHEMBL20913210 0.79 KDM4E (0.55) TDP1KDM4EALDH1A1ATM
SCHEMBL5678214 0.79 KCNA3 (0.52) SMN1; SMN2L3MBTL1MTNR1AMTNR1BTDP1
SCHEMBL183192 0.79 KCNA3 (0.52) SMN1; SMN2L3MBTL1MTNR1AMTNR1BTDP1
SCHEMBL5319605 0.76 LMNA (0.83) LMNASMN1; SMN2POLBL3MBTL1MAPT
SCHEMBL29742239 0.74 L3MBTL1 (0.77) LMNASMN1; SMN2POLBL3MBTL1MAPT
SCHEMBL29742293 0.74 L3MBTL1 (0.70) LMNASMN1; SMN2POLBL3MBTL1MAPT
SCHEMBL6200067 0.74 LMNA (0.69) LMNASMN1; SMN2POLBL3MBTL1MAPT
SCHEMBL3519346 0.74 LMNA (1.00) LMNASMN1; SMN2POLBL3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3134446-B1 AROMATIC GLYCOL ETHERS AS CO-MONOMERS IN HOLOGRAPHIC PHOTOPOLYMER FORMULAS COVESTRO DEUTSCHLAND AG (DE) 2019-04-24 EP disclosed
EP-3134446-A1 AROMATIC GLYCOL ETHERS AS WRITING MONOMERS IN HOLOGRAPHIC PHOTOPOLYMER FORMULATIONS Covestro Deutschland AG (DE) 2017-03-01 EP disclosed
WO-2015161969-A1 AROMATIC GLYCOL ETHERS AS WRITING MONOMERS IN HOLOGRAPHIC PHOTOPOLYMER FORMULATIONS BAYER MATERIAL SCIENCE AG (DE) 2015-10-29 WO disclosed