SCHEMBL17205376

SCHEMBL17205376

Cc1ccccc1OCCCC=C(O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.54
ALDH1A1 P00352 6/20 0.49
KDM4E B2RXH2 4/20 0.49
HTT P42858 1/20 0.49
MCL1 Q07820 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
RXRG P48443 1/20 0.46
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
NOTUM Q6P988 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL17205648 0.85 LMNA (0.58) TDP1ALDH1A1KDM4EL3MBTL1RXRA
SCHEMBL1535474 0.81 KDM4E (0.57) ALDH1A1KDM4EHTTL3MBTL1MEN1
SCHEMBL20913210 0.79 KDM4E (0.55) TDP1ALDH1A1KDM4EMCL1KMT2A
SCHEMBL5678214 0.79 KCNA3 (0.52) TDP1ALDH1A1KDM4EL3MBTL1MEN1
SCHEMBL183192 0.79 KCNA3 (0.52) TDP1ALDH1A1KDM4EL3MBTL1MEN1
SCHEMBL819713 0.79 ALDH1A1 (0.49) TDP1ALDH1A1KDM4EHTTMCL1
SCHEMBL8752667 0.76 TSHR (0.68) TDP1L3MBTL1RXRARXRBRXRG
SCHEMBL3043854 0.74 TSHR (0.61) TDP1ALDH1A1KDM4EHTTMCL1
SCHEMBL9808080 0.74 ALDH1A1 (0.62) TDP1ALDH1A1KDM4EHTTL3MBTL1
SCHEMBL11679951 0.74 CYP2D6 (0.61) TDP1ALDH1A1KDM4EHTTL3MBTL1

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