SCHEMBL21469985

SCHEMBL21469985

C=C(C)C(=O)Oc1ccc(-c2ccc(-c3ccc(OC=O)cc3)cc2C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.41
KMT2A Q03164 2/20 0.39
ATM Q13315 1/20 0.39
HSD17B1 P14061 1/20 0.36
ACACB O00763 2/20 0.34
ACACA Q13085 2/20 0.34
LMNA P02545 2/20 0.34
GAA P10253 1/20 0.34
SLC2A1 P11166 1/20 0.34
EPHX1 P07099 1/20 0.33
BACE1 P56817 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MAOB P27338 1/20 0.32
GAPDH P04406 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL940907 0.91 ELANE (0.48) ELANEKMT2AATMHSD17B1ACACB
SCHEMBL17750884 0.89 ELANE (0.42) ELANEKMT2AATMHSD17B1LMNA
SCHEMBL14984756 0.87 ELANE (0.39) ELANEKMT2AATMHSD17B1ACACB
SCHEMBL20428198 0.87 ELANE (0.51) ELANEKMT2AATMLMNAGAA
SCHEMBL18468604 0.87 ELANE (0.51) ELANEKMT2AATMLMNAGAA
SCHEMBL18435886 0.86 ELANE (0.40) ELANEKMT2AATMLMNAGAA
SCHEMBL13967533 0.86 ELANE (0.42) ELANEKMT2AATMHSD17B1ACACB
SCHEMBL21614479 0.86 BACE1 (0.48) ELANEKMT2AATMHSD17B1LMNA
SCHEMBL17309198 0.85 ELANE (0.48) ELANEKMT2AATMHSD17B1ACACB
SCHEMBL21470070 0.85 ELANE (0.41) ELANEKMT2AATMHSD17B1ACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3339396-B1 LIQUID CRYSTAL DISPLAY DEVICE AND LIQUID CRYSTAL COMPOSITION INCLUDED THEREIN SAMSUNG DISPLAY CO LTD (KR) 2019-10-16 EP disclosed