SCHEMBL20172066

SCHEMBL20172066

C=C(C)COC(c1ccc(-c2cccc(-c3ccc(OC(=O)C(=C)C)cc3)c2)cc1)C(C)(C)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.38
▸ LMNA P02545 3/20 0.37
▸ GAA P10253 1/20 0.37
▸ MAPT P10636 2/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ HPGD P15428 2/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ POLB P06746 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ FFAR1 O14842 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ CASP3 P42574 1/20 0.32
▸ SENP8 Q96LD8 1/20 0.32
▸ SENP7 Q9BQF6 1/20 0.32
▸ SENP6 Q9GZR1 1/20 0.32
▸ GFER P55789 1/20 0.31
▸ PTGS2 P35354 2/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ ACACB O00763 1/20 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
SCHEMBL21231952 0.93 ELANE (0.40) ELANELMNAMAPTKMT2AATM
SCHEMBL18806039 0.87 ELANE (0.41) ELANELMNAGAAMAPTTDP1
SCHEMBL25570450 0.83 ELANE (0.38) ELANELMNAGAAMAPTTDP1
SCHEMBL18806033 0.80 ELANE (0.39) ELANETDP1KMT2AATMPOLB
SCHEMBL18806020 0.79 ELANE (0.43) ELANELMNAGAAKMT2AATM
SCHEMBL20172055 0.79 ELANE (0.43) ELANELMNAGAAMAPTKMT2A
SCHEMBL2123965 0.79 ELANE (0.57) ELANELMNAGAAMAPTTDP1
SCHEMBL20172065 0.78 ABL1 (0.46) LMNAMAPTHPGDKMT2ATSHR
SCHEMBL18806035 0.77 ELANE (0.38) ELANEMAPTTDP1KMT2AATM
SCHEMBL23255224 0.76 ELANE (0.43) ELANEKMT2AATMACACBACACA

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-3162875-B1 POLYMERISABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2018-05-23 — — EP disclosed
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