SCHEMBL11835115

SCHEMBL11835115

CCN(Cc1ccccc1)C(=N)NO

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.56
▸ ALDH1A1 P00352 2/20 0.53
▸ MGLL Q99685 1/20 0.53
▸ HDAC1 Q13547 2/20 0.51
▸ HDAC6 Q9UBN7 2/20 0.51
▸ MAPK1 P28482 3/20 0.47
▸ TSHR P16473 3/20 0.47
▸ GRIN2D O15399 2/20 0.47
▸ GRIN3B O60391 2/20 0.47
▸ GRIN1 Q05586 2/20 0.47
▸ GRIN2A Q12879 2/20 0.47
▸ GRIN2B Q13224 2/20 0.47
▸ GRIN2C Q14957 2/20 0.47
▸ GRIN3A Q8TCU5 2/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ HDAC3 O15379 1/20 0.44
▸ HDAC7 Q8WUI4 1/20 0.44
▸ HDAC10 Q969S8 1/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44

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
SCHEMBL11834236 0.86 HDAC1 (0.54) LMNAALDH1A1MGLLHDAC1HDAC6
SCHEMBL8279944 0.81 LMNA (0.63) LMNAALDH1A1MGLLHDAC1HDAC6
SCHEMBL1794951 0.78 GRIN2D (0.74) LMNAALDH1A1MGLLMAPK1TSHR
SCHEMBL7320181 0.78 NPC1 (0.56) ALDH1A1MGLLHDAC1HDAC6TSHR
SCHEMBL1794953 0.78 GRIN2D (0.74) LMNAALDH1A1MGLLMAPK1TSHR
SCHEMBL4827830 0.76 ALOX5 (0.43) ALDH1A1MGLLHDAC1HDAC6TSHR
SCHEMBL6310778 0.75 LMNA (0.47) LMNAALDH1A1MGLLMAPK1TSHR
SCHEMBL1195514 0.75 LMNA (0.78) LMNAALDH1A1MGLLHDAC1HDAC6
SCHEMBL967319 0.74 LMNA (0.70) LMNAALDH1A1MGLLHDAC1HDAC6
SCHEMBL9313719 0.73 LMNA (0.53) LMNAALDH1A1MGLLMAPK1TSHR

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
US-3954995-A Mono-and disubstituted hydroxyguanidines in the treatment of depression E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-05-04 — — US claimed
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