SCHEMBL7094852

SCHEMBL7094852

Cc1ccc(S(=O)(=O)NCCCCNS(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 14/20 0.79
CA12 O43570 1/20 0.74
CA2 P00918 1/20 0.74
CA9 Q16790 1/20 0.74
ALOX15 P16050 1/20 0.72
MEN1 O00255 2/20 0.70
KMT2A Q03164 2/20 0.70
HTT P42858 2/20 0.67
MBTD1 Q05BQ5 1/20 0.66
L3MBTL1 Q9Y468 1/20 0.66
LMNA P02545 3/20 0.65
PKM P14618 3/20 0.65
KDM4E B2RXH2 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
HPGD P15428 1/20 0.62
NPSR1 Q6W5P4 1/20 0.60
GAA P10253 1/20 0.60

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
SCHEMBL7095731 0.98 ALDH1A1 (0.77) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL7093365 0.98 ALDH1A1 (0.77) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL7095193 0.98 ALDH1A1 (0.77) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL7095949 0.98 ALDH1A1 (0.77) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL7097551 0.98 ALDH1A1 (0.77) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL7092896 0.98 ALDH1A1 (0.77) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL7201051 0.96 ALDH1A1 (0.86) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL3969095 0.94 ALDH1A1 (0.72) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL635208 0.93 ALDH1A1 (0.70) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL5567042 0.91 ALDH1A1 (0.75) ALDH1A1CA12CA2CA9ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6627399-B1 Using compound of given formula as accelerator RIKEN (JP) 2003-09-30 US disclosed
US-6605645-B2 Such as 1,15-di(cyclopropylmethylamino)-8-benzyl-4,8,12-triazapentadecane; carcinostatic action RIKEN (JP) 2003-08-12 US disclosed
US-20030073202-A1 RNA polymerase transcription promoter and nucleic acid sequencing method IWATA MASAAKI (JP) 2003-04-17 US disclosed
US-20020067472-A1 Linear polyamine compounds and polyamine anticancer agents IWATA MASAAKI (JP) 2002-06-06 US disclosed
US-6319956-B1 N1, N4-BIS(CYCLOPROPYLMETHYLAMINO)TRIALKYLENETETRAMINES THAT MAY BE TOLUENESULFONATED. RIKEN (JP) 2001-11-20 US disclosed
EP-1061130-A1 RNA POLYMERASE TRANSCRIPTION PROMOTERS AND METHOD FOR DETERMINING BASE SEQUENCE Riken (JP) 2000-12-20 EP disclosed
JP-2000184886-A RNA POLYMERASE TRANSCRIPTION PROMOTER AND METHOD OF DETERMINING BASE SEQUENCE INST OF PHYSICAL & CHEMICAL RES 2000-07-04 JP disclosed