SCHEMBL5372417

SCHEMBL5372417

COc1ccc(N(Cc2ccc([N+]#N)cc2)C(=O)OCC2c3ccccc3-c3ccccc32)c(OC)c1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FABP5 Q01469 1/20 0.39
▸ TSHR P16473 5/20 0.36
▸ HTT P42858 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ GPR55 Q9Y2T6 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ TSPO P30536 2/20 0.34
▸ BCL2A1 Q16548 1/20 0.34
▸ BMP1 P13497 1/20 0.33
▸ ACHE P22303 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
SCHEMBL28069712 0.91 FABP5 (0.45) FABP5TSHRHTTMEN1KMT2A
SCHEMBL208874 0.90 FABP5 (0.41) FABP5TSHRHTTMEN1KMT2A
SCHEMBL4784032 0.90 FABP5 (0.41) FABP5TSHRHTTMEN1KMT2A
SCHEMBL1526171 0.89 FABP5 (0.40) FABP5TSHRHTTMEN1KMT2A
SCHEMBL6298094 0.88 FABP5 (0.42) FABP5TSHRHTTMEN1KMT2A
SCHEMBL5670740 0.86 FABP5 (0.39) FABP5TSHRHTTMEN1KMT2A
SCHEMBL3433024 0.86 HSD17B10 (0.39) FABP5TSHRHTTMEN1KMT2A
SCHEMBL2637405 0.84 FABP5 (0.39) FABP5MEN1KMT2ATSPOBMP1
SCHEMBL3805522 0.84 BMP1 (0.37) FABP5TSHRHTTMEN1KMT2A
SCHEMBL17500350 0.84 NPC1 (0.43) FABP5TSHRMEN1KMT2AGPR55

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7229668-B2 Process for the electrochemical production of a carbon-containing material whose surface is modified with organic groups, and use of the modified material CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2007-06-12 — — US claimed
CN-101426589-A By selective chemical modification carbon nanotube coating is formed pattern ELKOS INC (US) 2009-05-06 — — CN disclosed
US-7229668-B2 Process for the electrochemical production of a carbon-containing material whose surface is modified with organic groups, and use of the modified material CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2007-06-12 — — US disclosed
US-20020144912-A1 Process for the electrochemical production of a carbon-containing material whose surface is modified with organic groups, and use of the modified material CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) 2002-10-10 — — US disclosed
US-6435240-B1 Process for the electrochemical production of a carbon-containing material whose surface is modified with organic groups, and use of the modified material CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2002-08-20 — — US disclosed
EP-0970265-B1 METHOD FOR PRODUCING BY ELECTROCHEMICAL PROCESS A CARBON-CONTAINING MATERIAL WITH ITS SURFACE MODIFIED BY ORGANIC GROUPS, USE OF THE MODIFIED MATERIAL CENTRE NAT RECH SCIENT (FR) 2002-07-03 — — EP disclosed
EP-0970265-A1 METHOD FOR PRODUCING BY ELECTROCHEMICAL PROCESS A CARBON-CONTAINING MATERIAL WITH ITS SURFACE MODIFIED BY ORGANIC GROUPS, USE OF THE MODIFIED MATERIAL CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2000-01-12 — — EP disclosed
WO-1998044172-A1 METHOD FOR PRODUCING BY ELECTROCHEMICAL PROCESS A CARBON-CONTAINING MATERIAL WITH ITS SURFACE MODIFIED BY ORGANIC GROUPS, USE OF THE MODIFIED MATERIAL CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S) (FR) 1998-10-08 — — WO disclosed
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