SCHEMBL21101846

SCHEMBL21101846

C=C(C(=O)Oc1ccc(-c2ccc(OC(=O)C(=C)C(F)(F)F)c(OC(=O)C(=C)C(F)(F)F)c2)cc1)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.40
LMNA P02545 2/20 0.33
GAA P10253 1/20 0.33
AURKA O14965 1/20 0.32
TPX2 Q9ULW0 1/20 0.32
ELANE P08246 1/20 0.32
HSD17B10 Q99714 2/20 0.32
RXRA P19793 2/20 0.32
RXRB P28702 2/20 0.32
RXRG P48443 2/20 0.32
PTPN5 P54829 2/20 0.32
HDAC1 Q13547 3/20 0.31
HDAC2 Q92769 3/20 0.31
HDAC3 O15379 2/20 0.31
HDAC4 P56524 2/20 0.31
HDAC7 Q8WUI4 2/20 0.31
HDAC10 Q969S8 2/20 0.31
HDAC11 Q96DB2 2/20 0.31
HDAC8 Q9BY41 2/20 0.31
HDAC6 Q9UBN7 2/20 0.31

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
SCHEMBL15342832 0.90 KDM4E (0.32) HSD17B10RXRAPTPN5MAPTMEN1
SCHEMBL2604658 0.86 LMNA (0.43) KIF11LMNAGAAPTPN5HDAC1
SCHEMBL15342844 0.86 GAPDH (0.33) KIF11HSD17B10MAPTMEN1KMT2A
SCHEMBL15339088 0.84 ELANE (0.36) GAAELANEHSD17B10RXRAPTPN5
SCHEMBL2606420 0.84 PTPN5 (0.47) KIF11LMNAGAARXRARXRB
SCHEMBL15342833 0.83 KDM4E (0.38) GAAHSD17B10HDAC1MAPTKMT2A
SCHEMBL14507232 0.83 RXRA (0.44) LMNAHSD17B10RXRARXRBRXRG
SCHEMBL21101844 0.81 BACE1 (0.38) KIF11ELANERXRARXRBRXRG
SCHEMBL15339126 0.81 ELANE (0.36) ELANEHSD17B10MAPTTDP1MEN1
SCHEMBL22250959 0.80 PRSS1 (0.43) KIF11LMNAELANEHSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11015122-B2 Liquid crystal composition and liquid crystal display element SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2021-05-25 US disclosed
US-20190185752-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT Shijiazhuang Chengzhi Yonghua Display Material Co., Ltd (CN) 2019-06-20 US disclosed