SCHEMBL19233211

SCHEMBL19233211

CC(C)(CCOC(C)(C)C)NC(=O)c1ccc(B(O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 6/20 0.46
▸ POLB P06746 1/20 0.40
▸ EGLN1 Q9GZT9 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ NAMPT P43490 1/20 0.34
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ ATM Q13315 1/20 0.33

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
SCHEMBL18697940 0.87 TRPV1 (0.42) TRPV1POLBHTTNAMPT
SCHEMBL14314081 0.83 TRPV1 (0.39) TRPV1POLBNPC1RAB9A
SCHEMBL18652074 0.81 TRPV1 (0.44) TRPV1HTTNAMPTRAB9A
SCHEMBL18646429 0.81 POLB (0.40) TRPV1POLBEGLN1HTTNAMPT
SCHEMBL19465881 0.78 POLB (0.38) POLB
SCHEMBL1961940 0.75 TRPV1 (0.58) TRPV1HTT
SCHEMBL23870191 0.75 AOC3 (0.40) POLBHTTNPC1RAB9A
SCHEMBL17635466 0.73 TRPV1 (0.44) TRPV1POLBNPC1RAB9A
SCHEMBL18698021 0.72 TRPV1 (0.46) TRPV1HTTNAMPTRAB9A
SCHEMBL20932834 0.72 POLB (0.39) POLBNPC1RAB9AATM

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-2017134188-A1 NOVEL DIHYDROPYRIDINONE AND DIHYDROPYRIMIDINONE COMPOUNDS AND THEIR USE UNIVERSITE DE LILLE 2 DROIT ET SANTE (FR) 2017-08-10 — — WO disclosed
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