SCHEMBL20428198

SCHEMBL20428198

C=C(C)C(=O)Oc1ccc(-c2ccc(-c3ccc(OC=O)cc3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.51
KMT2A Q03164 4/20 0.48
ATM Q13315 1/20 0.48
HSD17B10 Q99714 1/20 0.41
LMNA P02545 3/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 4/20 0.35
TDP1 Q9NUW8 2/20 0.33
POLB P06746 2/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33
MEN1 O00255 2/20 0.33
KIF11 P52732 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TTR P02766 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.32

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
SCHEMBL18468604 1.00 ELANE (0.51) ELANEKMT2AATMHSD17B10LMNA
SCHEMBL28126189 0.95 ELANE (0.56) ELANEKMT2AATMHSD17B10LMNA
SCHEMBL21417777 0.91 ELANE (0.48) ELANEKMT2AATMHSD17B10LMNA
SCHEMBL17750884 0.88 ELANE (0.42) ELANEKMT2AATMHSD17B10LMNA
SCHEMBL12872192 0.88 ELANE (0.62) ELANEKMT2AATMHSD17B10LMNA
SCHEMBL803168 0.88 ELANE (0.62) ELANEKMT2AATMHSD17B10LMNA
SCHEMBL17433304 0.88 ELANE (0.62) ELANEKMT2AATMHSD17B10LMNA
SCHEMBL18436419 0.87 ELANE (0.43) ELANEKMT2AATMHSD17B10SMN1; SMN2
SCHEMBL18823077 0.87 ELANE (0.51) ELANEKMT2AATMHSD17B10LMNA
SCHEMBL21469985 0.87 ELANE (0.41) ELANEKMT2AATMHSD17B10LMNA

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-4306615-A1 LIQUID-CRYSTAL MEDIUM Merck Patent GmbH (DE) 2024-01-17 EP disclosed
EP-3933009-A1 LIQUID CRYSTAL MEDIUM Merck Patent GmbH (DE) 2022-01-05 EP disclosed
EP-2957618-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2018-08-01 EP disclosed