SCHEMBL27709486

SCHEMBL27709486

O=C=NC1CCCCC1=O

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
KMT2A Q03164 1/20 0.40
MCL1 Q07820 1/20 0.32
MAPT P10636 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
SCHEMBL28255892 0.77 ALDH1A1 (0.41) ALDH1A1
SCHEMBL11154756 0.77 CA1 (0.48) ALDH1A1CA1CA2CA4KMT2A
SCHEMBL3467293 0.75 KMT2A (0.50) ALDH1A1CA1CA2CA4KMT2A
SCHEMBL2632690 0.75
SCHEMBL7083818 0.74 ALDH1A1 (0.39) ALDH1A1
SCHEMBL28708985 0.73
SCHEMBL8776291 0.71 KMT2A (0.46) ALDH1A1CA1CA2CA4KMT2A
SCHEMBL10760687 0.71 KMT2A (0.46) ALDH1A1CA1CA2CA4KMT2A
SCHEMBL8522333 0.71 KMT2A (0.46) ALDH1A1CA1CA2CA4KMT2A
SCHEMBL8982229 0.71 ALDH1A1 (0.40) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105985335-B Hydroxamic acid compound, preparation method and its usage 成都地奥九泓制药厂 2018-06-08 CN disclosed
CN-105764900-B CRTH2 agonist compounds and application thereof 广东东阳光药业有限公司 2018-04-03 CN disclosed
CN-101469423-A Metal surface treating composition and surface treating metal material with metal surface treating film obtained therefrom KANSAI COATINGS CO LTD (JP) 2009-07-01 CN disclosed
CN-101469422-A Metal surface treating composition and surface treating metal material with metal surface treating film obtained therefrom KANSAI COATINGS CO LTD (JP) 2009-07-01 CN disclosed
CN-101237885-A Agent for regeneration and/or protection of nerves ONO PHARMACEUTICAL CO (JP) 2008-08-06 CN disclosed