SCHEMBL21483023

SCHEMBL21483023

C=C(C)C(=O)Oc1ccc(-c2cc(C)c(-c3ccc(OC(=O)C(=C)C)c(OC(=O)C(=C)C)c3)cc2C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.44
KMT2A Q03164 3/20 0.42
ATM Q13315 1/20 0.42
GAPDH P04406 2/20 0.39
BACE1 P56817 2/20 0.39
ADORA3 P0DMS8 3/20 0.36
ADORA2A P29274 1/20 0.36
RARB P10826 1/20 0.34
SNCA P37840 1/20 0.34
MAOB P27338 1/20 0.34
KDM4E B2RXH2 2/20 0.33
HSD17B10 Q99714 2/20 0.33
HSD17B1 P14061 1/20 0.33
LMNA P02545 1/20 0.33
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
ALOX12 P18054 1/20 0.33
MAPK1 P28482 1/20 0.33
CASP1 P29466 1/20 0.33

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
SCHEMBL17625832 0.96 BACE1 (0.46) ELANEKMT2AATMGAPDHBACE1
SCHEMBL20275906 0.91 ELANE (0.51) ELANEKMT2AATMGAPDHBACE1
SCHEMBL21101680 0.90 ELANE (0.43) ELANEKMT2AATMGAPDHBACE1
SCHEMBL20174158 0.89 ELANE (0.43) ELANEKMT2AATMGAPDHBACE1
SCHEMBL17625863 0.89 BACE1 (0.41) ELANEKMT2AATMGAPDHBACE1
SCHEMBL17625681 0.89 BACE1 (0.51) ELANEKMT2AATMGAPDHBACE1
SCHEMBL17625747 0.87 BACE1 (0.50) ELANEKMT2AATMGAPDHBACE1
SCHEMBL21470054 0.87 ELANE (0.51) ELANEKMT2AATMGAPDHBACE1
SCHEMBL17625853 0.86 ELANE (0.47) ELANEKMT2AATMGAPDHBACE1
SCHEMBL15625536 0.85 ELANE (0.51) ELANEKMT2AATMGAPDHBACE1

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-11078421-B2 Liquid crystal composition and display using composition SHIJIAZHUANG CHENGZHI YOUNGHUA DISPLAY MATERIAL CO., LTD. (CN) 2021-08-03 US disclosed
US-20190316038-A1 LIQUID CRYSTAL COMPOSITION AND DISPLAY USING COMPOSITION SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2019-10-17 US disclosed