SCHEMBL22196862

SCHEMBL22196862

C=CC(=O)OCCOC(=O)NCCCCCCNC(=O)NCC

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.50
TSHR P16473 2/20 0.46
HPGD P15428 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CYP3A4 P08684 1/20 0.46
EPHX2 P34913 1/20 0.43
EPHX1 P07099 1/20 0.42

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
SCHEMBL17081963 0.88 TSHR (0.56) ACHETSHRHPGDALDH1A1CYP3A4
SCHEMBL11511294 0.88 TSHR (0.59) ACHETSHRHPGDALDH1A1CYP3A4
SCHEMBL5942991 0.88 TSHR (0.59) ACHETSHRHPGDALDH1A1CYP3A4
SCHEMBL13032936 0.87 ACHE (0.64) ACHETSHRHPGDEPHX2EPHX1
SCHEMBL13032932 0.87 ACHE (0.64) ACHETSHRHPGDEPHX2EPHX1
SCHEMBL18094738 0.87 ACHE (0.64) ACHETSHRHPGDEPHX2EPHX1
SCHEMBL8014074 0.87 ACHE (0.64) ACHETSHRHPGDEPHX2EPHX1
SCHEMBL13032931 0.87 ACHE (0.64) ACHETSHRHPGDEPHX2EPHX1
SCHEMBL6342865 0.87 ACHE (0.64) ACHETSHRHPGDEPHX2EPHX1
SCHEMBL18094637 0.87 ACHE (0.64) ACHETSHRHPGDEPHX2EPHX1

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-11548962-B2 Self-healing polymer network containing physical crosslinker, composition therefor, and optical element comprising the same INDUSTRY-UNIVERSITY COOPERATION FOUNDATION HANYANG UNIVERSITY (KR) 2023-01-10 US disclosed
US-20200216581-A1 SELF-HEALING POLYMER NETWORK CONTAINING PHYSICAL CROSSLINKER, COMPOSITION THEREFOR, AND OPTICAL ELEMENT COMPRISING THE SAME INDUSTRY-UNIVERSITY COOPERATION FOUNDATION HANYANG UNIVERSITY (KR) 2020-07-09 US disclosed