SCHEMBL7063202

SCHEMBL7063202

CCCCN(CCCC)C(=S)NC(=O)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.69
LMNA P02545 5/20 0.69
L3MBTL1 Q9Y468 4/20 0.69
HTT P42858 3/20 0.69
SMN1; SMN2 Q16637 3/20 0.69
GAA P10253 3/20 0.69
HDAC1 Q13547 2/20 0.56
HDAC6 Q9UBN7 2/20 0.56
ALOX12 P18054 3/20 0.53
NPSR1 Q6W5P4 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
KDM4E B2RXH2 1/20 0.52
TDP1 Q9NUW8 2/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
GPR55 Q9Y2T6 1/20 0.52

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
SCHEMBL5447985 0.94 ALDH1A1 (0.66) ALDH1A1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL22506569 0.88 ALDH1A1 (0.58) ALDH1A1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL5451660 0.85 ALDH1A1 (0.68) ALDH1A1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL7149041 0.84 ALDH1A1 (0.57) ALDH1A1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL16587387 0.82 ALDH1A1 (0.61) ALDH1A1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL7060011 0.81 GAA (0.55) ALDH1A1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL11569726 0.80 HDAC1 (0.51) ALDH1A1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL7475776 0.79 ALDH1A1 (0.51) ALDH1A1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL5457229 0.78 ALDH1A1 (0.57) ALDH1A1LMNAL3MBTL1HTTSMN1; SMN2
SCHEMBL10400661 0.76 PKM (0.66) ALDH1A1LMNAL3MBTL1HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1312986-A1 Magenta-colored toner particles for electrostatographic imaging NexPress Solutions LLC (US) 2003-05-21 EP disclosed
US-6528223-B1 Particle composition comprising binder polymer and specified dye having various substituents introduced into aromatic ring at thiazolyl 4-position, to avoid tendency toward dye crystallization NEXPRESS SOLUTIONS LLC 2003-03-04 US disclosed
US-5015448-A Particulate material suitable for selectively separating metal cations from aqueous solutions, process for its production, and use thereof GUTEC GESELLSCHAFT ZUR ENTWICKLUNG VON UMWELTSCHUTZTECHNOLOGIE MBH (DE) 1991-05-14 US disclosed
US-4980071-A PRECIPITATION OF HEAVY METAL COMPOUNDS; WASTE WATER TREATMENT DEGUSSA AKTIENGESELLSCHAFT (DE) 1990-12-25 US disclosed
US-4571265-A Process for separation and purification of platinum group metals (II) DEGUSSA AKTIENGESELLSCHAFT (DE) 1986-02-18 US disclosed
US-4571266-A USING THIOUREA EXTRACTING AGENT DEGUSSA AKTIENGESELLSCHAFT (DE) 1986-02-18 US disclosed