SCHEMBL11567644

SCHEMBL11567644

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.47
PKM P14618 2/20 0.46
LIMK1 P53667 1/20 0.46
LIMK2 P53671 1/20 0.46
ALDH1A1 P00352 3/20 0.45
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45
KDM4E B2RXH2 1/20 0.43
ALDH2 P05091 1/20 0.42
CA2 P00918 2/20 0.42
TSHR P16473 1/20 0.41
LMNA P02545 1/20 0.40
METAP2 P50579 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39
ESR1 P03372 1/20 0.39
NR1I2 O75469 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL11568325 0.86 KDM4E (0.48) PKMLIMK1LIMK2ALDH1A1GAA
SCHEMBL11570389 0.77 ALDH1A1 (0.45) PKMALDH1A1GAAHPGDKDM4E
SCHEMBL11570397 0.76 ALDH1A1 (0.53) TDP1PKMALDH1A1KDM4EALDH2
SCHEMBL11569726 0.74 HDAC1 (0.51) PKMALDH1A1GAAHPGDALDH2
SCHEMBL11568845 0.74 CA2 (0.49) ALDH1A1GAAHPGDKDM4ECA2
SCHEMBL11569916 0.71 KMT2A (0.48) PKMALDH1A1GAAHPGDKDM4E
SCHEMBL11574958 0.71 CA2 (0.49) KDM4ECA2LMNAL3MBTL1CA1
SCHEMBL9872134 0.70 ALDH1A1 (0.53) PKMALDH1A1GAAHPGDALDH2
SCHEMBL11571468 0.69 NAAA (0.50) ALDH1A1GAALMNAL3MBTL1SMN1; SMN2
SCHEMBL11570804 0.69 CA2 (0.50) PKMALDH1A1GAAHPGDKDM4E

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
EP-0004711-A2 Process for the cross-linking of polymers Vulnax International Limited (GB) 1979-10-17 EP disclosed