SCHEMBL7680708

SCHEMBL7680708

[CH2]c1ccc(NC(=N)N(C)c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.46
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
LMNA P02545 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 5/20 0.39
NPC1 O15118 1/20 0.39
PKM P14618 1/20 0.39
RAB9A P51151 1/20 0.39
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TSHR P16473 1/20 0.37
FAAH O00519 1/20 0.37
PHGDH O43175 1/20 0.37
MGLL Q99685 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37

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
SCHEMBL9113008 0.88 HTT (0.49) HTTKMT2AMEN1LMNAL3MBTL1
SCHEMBL174242 0.80 KDM4E (0.50) HTTKMT2ALMNAL3MBTL1RAB9A
SCHEMBL18929814 0.77 TAAR1 (0.47) HTTKMT2ALMNAALDH1A1CA1
SCHEMBL11836946 0.72 LMNA (0.48) HTTKMT2AMEN1LMNAL3MBTL1
SCHEMBL4979740 0.72 NOX1 (0.64) KMT2AMEN1ALDH1A1NPC1RAB9A
SCHEMBL4980435 0.71 NR1H4 (0.46) HTTKMT2AMEN1NPC1RAB9A
SCHEMBL7421824 0.71 LMNA (0.47) HTTKMT2AMEN1LMNAL3MBTL1
SCHEMBL8612474 0.70 ALDH1A1 (0.51) ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL2001630 0.70 TAS2R38 (0.46) KMT2AMEN1ALDH1A1NPC1PKM
Bromide SCHEMBL5466183 0.70 NR1H4 (0.44) HTTKMT2AMEN1NPC1RAB9A

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-6376538-B1 ANTIINFLAMMATORY AGENTS; AUTOIMMUNE DISEASES BIOGEN, INC. 2002-04-23 US claimed