SCHEMBL18688987

SCHEMBL18688987

O=CN1CCC(OC/C=N/OCc2ccccc2)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 2/20 0.38
▸ TMEM97 Q5BJF2 1/20 0.36
▸ CARM1 Q86X55 1/20 0.36
▸ PRMT6 Q96LA8 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.36
▸ PRMT8 Q9NR22 1/20 0.36
▸ HRH3 Q9Y5N1 1/20 0.36
▸ CTSL P07711 2/20 0.35
▸ CTSB P07858 2/20 0.35
▸ CTSK P43235 2/20 0.35
▸ CTSV O60911 1/20 0.35
▸ CTSS P25774 1/20 0.35
▸ CTSC P53634 1/20 0.35
▸ CTSF Q9UBX1 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ AGTR2 P50052 2/20 0.34
▸ BCHE P06276 1/20 0.34

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
SCHEMBL29563754 0.84 NAAA (0.50) NAAATMEM97CARM1PRMT6SIGMAR1
SCHEMBL18669284 0.83 SMN1; SMN2 (0.41) NAAANPC1RAB9AAGTR2BCHE
SCHEMBL18669285 0.83 SMN1; SMN2 (0.41) NAAANPC1RAB9AAGTR2BCHE
SCHEMBL18669294 0.79 LMNA (0.39) NPC1RAB9ABCHENAMPT
SCHEMBL18669297 0.79 LMNA (0.39) NPC1RAB9ABCHENAMPT
SCHEMBL18689001 0.77 JAK2 (0.50) —
SCHEMBL20515959 0.77 JAK2 (0.50) —
SCHEMBL20515963 0.73 PRMT5 (0.49) BCHE
SCHEMBL8149847 0.71 CHRM2 (0.60) NAAANPC1RAB9A
SCHEMBL27398370 0.69 CARM1 (0.53) NAAACARM1PRMT6LIPG

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-2017050714-A1 PYRIDINONE DICARBOXAMIDE FOR USE AS BROMODOMAIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-03-30 — — WO disclosed
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