SCHEMBL3790091

SCHEMBL3790091

CCCCc1ccc2ccsc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 7/20 0.43
SENP8 Q96LD8 7/20 0.43
SENP7 Q9BQF6 7/20 0.43
SENP6 Q9GZR1 7/20 0.43
SKP2 Q13309 1/20 0.43
CYP2A6 P11509 1/20 0.41
NPC1 O15118 2/20 0.39
MAPK1 P28482 2/20 0.39
RAB9A P51151 2/20 0.39
HPGD P15428 2/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL20126467 0.95 ESR1 (0.42) CASP3SENP8SENP7SENP6CYP2A6
SCHEMBL28195850 0.93 PTGS2 (0.44) TP53ALDH1A1HSD17B10
SCHEMBL28384923 0.93 PTGS2 (0.44) TP53ALDH1A1HSD17B10
SCHEMBL28382067 0.93 PTGS2 (0.44) TP53ALDH1A1HSD17B10
SCHEMBL3799097 0.89 CYP2A6 (0.43) CASP3SENP8SENP7SENP6CYP2A6
SCHEMBL3793629 0.86 CYP2A6 (0.58) CASP3SENP8SENP7SENP6SKP2
SCHEMBL28351685 0.82 RARB (0.45) RAB9AHPGDCA2TP53SMN1; SMN2
SCHEMBL2092291 0.82 CYP2A6 (0.41) CASP3SENP8SENP7SENP6CYP2A6
SCHEMBL28348154 0.81 HSD17B10 (0.48) RAB9AHPGDTP53SMN1; SMN2ALDH1A1
SCHEMBL28351935 0.81 HSD17B10 (0.48) RAB9AHPGDTP53SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7645400-B2 Composition containing carbon nanotubes having a coating MITSUBISHI RAYON CO., LTD. (JP) 2010-01-12 US disclosed
US-20090321688-A1 Carbon Nanotube Composition, Composite Having a Coated Film Composed of the Same, and Their Production Methods MITSUBISHI RAYON CO., LTD. (JP) 2009-12-31 US disclosed
US-20060052509-A1 Composition containing carbon nanotubes having coating thereof and process for producing them MITSUBISHI RAYON CO., LTD. (JP) 2006-03-09 US disclosed