SCHEMBL8425402

SCHEMBL8425402

O=C=NC1=CCC(N=C=O)C1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL22604260 1.00 ALDH1A1 (0.35) ALDH1A1
SCHEMBL8014623 0.81 ALDH1A1 (0.38) ALDH1A1
SCHEMBL77709 0.81 ALDH1A1 (0.38) ALDH1A1
SCHEMBL9358004 0.78 ALDH1A1 (0.44) ALDH1A1
SCHEMBL9358319 0.77 ALDH1A1 (0.47) ALDH1A1
SCHEMBL3891088 0.77 ALDH1A1 (0.47) ALDH1A1
SCHEMBL13927598 0.69
SCHEMBL374829 0.68 ALDH1A1 (0.30) ALDH1A1
SCHEMBL14679718 0.68
SCHEMBL1193046 0.64 ANPEP (0.39) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115003721-A Aqueous electrocoating containing silane-containing crosslinking agent 巴斯夫涂料有限公司 2022-09-02 CN disclosed
US-5908378-A Bi-ventricular cardiac assist device DUKE UNIVERSITY (US) 1999-06-01 US disclosed
US-5738627-A Bi-ventricular cardiac assist device DUKE UNIVERSITY (US) 1998-04-14 US disclosed