SCHEMBL6441949

SCHEMBL6441949

C=C1C(N=C=O)CCCC1N=C=O

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL6903477 0.78 ALDH1A1 (0.41) ALDH1A1
SCHEMBL28255892 0.78 ALDH1A1 (0.41) ALDH1A1
SCHEMBL27709486 0.70 ALDH1A1 (0.43) ALDH1A1
SCHEMBL28137164 0.68 ALDH1A1 (0.32) ALDH1A1
SCHEMBL14523885 0.67 ALDH1A1 (0.83) ALDH1A1
SCHEMBL540664 0.67
SCHEMBL26610 0.67 ALDH1A1 (0.50) ALDH1A1
SCHEMBL10624750 0.66 ALDH1A1 (0.43) ALDH1A1
SCHEMBL6442882 0.66 ALDH1A1 (0.39) ALDH1A1
SCHEMBL7083818 0.66 ALDH1A1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050101688-A1 Polymeric material applicable for making data-recording layer or multi-layer recording medium TEX YEAR INDUSTRIES INC. (TW) 2005-05-12 US claimed
US-20050101688-A1 Polymeric material applicable for making data-recording layer or multi-layer recording medium TEX YEAR INDUSTRIES INC. (TW) 2005-05-12 US disclosed