SCHEMBL9803606

SCHEMBL9803606

CCc1ccccc1CC=NO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.41
GABRB2 P47870 4/20 0.41
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MGLL Q99685 1/20 0.34
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
MAPT P10636 2/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
CTBP2 P56545 1/20 0.33
PDK2 Q15119 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL28370304 0.79 CTBP2 (0.44) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL28738484 0.77 ALDH1A1 (0.47) MEN1KMT2AMAPTALDH1A1L3MBTL1
SCHEMBL7012686 0.77 HSPA5 (0.50) MAPTALDH1A1L3MBTL1
Water SCHEMBL5700740 0.76 GABRA1 (0.55) GABRA1GABRB2MGLLMAPTALDH1A1
SCHEMBL3636312 0.75 TAAR1 (0.42) MEN1KMT2AALDH1A1
SCHEMBL9495997 0.75 FOLH1 (0.50) MAPTALDH1A1GAA
SCHEMBL25620245 0.75 GABRA1 (0.33) GABRA1GABRB2MGLLMAPTNPSR1
SCHEMBL9496006 0.75 FOLH1 (0.50) MAPTALDH1A1GAA
Hydrogen Peroxide SCHEMBL10890655 0.74 GABRA1 (0.60) GABRA1GABRB2MGLLMAPTALDH1A1
Hydrogen Peroxide SCHEMBL11205186 0.74 GABRA1 (0.60) GABRA1GABRB2MGLLMAPTALDH1A1

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
EP-0417167-A1 PROCESS FOR THE SYNTHESIS OF O-SUBSTITUTED OXIME COMPOUNDS AlliedSignal Inc. (US) 1991-03-20 EP disclosed
WO-1989011473-A1 PROCESS FOR THE SYNTHESIS OF O-SUBSTITUTED OXIME COMPOUNDS ALLIED-SIGNAL INC. (US) 1989-11-30 WO disclosed
US-4614813-A Process for the preparation of N-hydroxy organo imidate compounds ALLIED CORPORATION (US) 1986-09-30 US disclosed
EP-0158153-A2 Process for the preparation of N-hydroxy organo imidate compounds ALLIED CORPORATION (US) 1985-10-16 EP disclosed
EP-0158159-A1 Process for the synthesis of o-substituted oxime compounds and the conversion thereof into the corresponding hydroxylamine o-substituted AlliedSignal Inc. (US) 1985-10-16 EP disclosed