SCHEMBL27367369

SCHEMBL27367369

COCCOCCN(C)I

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.33
CA2 P00918 2/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL20323928 1.00 PIK3CD (0.33) PIK3CDCA2CA12CA1CA9
SCHEMBL14768910 0.84
SCHEMBL5450680 0.79 CA2 (0.48) PIK3CDCA2CA12CA1CA9
SCHEMBL18811754 0.79 PIK3CD (0.46) PIK3CDCA2CA12CA1CA9
SCHEMBL28352476 0.79 CA2 (0.48) PIK3CDCA2CA12CA1CA9
SCHEMBL19762046 0.79 PIK3CD (0.46) PIK3CDCA2CA12CA1CA9
SCHEMBL3436796 0.79 CA2 (0.48) PIK3CDCA2CA12CA1CA9
SCHEMBL28356492 0.79 CA2 (0.48) PIK3CDCA2CA12CA1CA9
SCHEMBL23101786 0.77 PIK3CD (0.50) PIK3CDCA2CA12CA1CA9
Hydrochloric Acid SCHEMBL29100726 0.77 CA2 (0.47) PIK3CDCA2CA12CA1CA9

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024054766-A2 MITOCHONDRIAL UNCOUPLERS FOR TREATMENT OF METABOLIC DISEASES AND CANCER MITO BIOPHARMA, LLC (US) 2024-03-14 WO disclosed