SCHEMBL19217162

SCHEMBL19217162

O=C=NCC1C2CCCC(C2)C1CN=C=O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL31293680 0.91
SCHEMBL29067235 0.79
SCHEMBL13975701 0.78
SCHEMBL29395871 0.77
SCHEMBL20462167 0.74 ALDH1A1 (0.31) ALDH1A1
SCHEMBL43488 0.74 ALDH1A1 (0.31) ALDH1A1
SCHEMBL1069198 0.74 ALDH1A1 (0.31) ALDH1A1
SCHEMBL1069199 0.74 ALDH1A1 (0.31) ALDH1A1
SCHEMBL1081630 0.74 ALDH1A1 (0.31) ALDH1A1
SCHEMBL19751822 0.74 ALDH1A1 (0.31) ALDH1A1

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-10202483-B2 Polymerizable composition, molded product, and use thereof MITSUI CHEMICALS, INC. (JP) 2019-02-12 US disclosed
US-20170226267-A1 POLYMERIZABLE COMPOSITION, MOLDED PRODUCT, AND USE THEREOF MITSUI CHEMICALS, INC. (JP) 2017-08-10 US disclosed