SCHEMBL7094855

SCHEMBL7094855

Cc1ccc(S(=O)(=O)NCCCN2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.59
MBTD1 Q05BQ5 1/20 0.59
ALDH1A1 P00352 7/20 0.57
CA12 O43570 2/20 0.54
CA9 Q16790 2/20 0.54
CA2 P00918 1/20 0.54
HTR1A P08908 1/20 0.53
ALOX15 P16050 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
CYP1A2 P05177 2/20 0.51
CYP3A4 P08684 2/20 0.51
USP2 O75604 1/20 0.51
ESR1 P03372 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CASP1 P29466 1/20 0.51
CYP2C19 P33261 1/20 0.51
GAA P10253 1/20 0.51

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
SCHEMBL7095382 0.96 HTR1A (0.58) L3MBTL1MBTD1ALDH1A1CA12CA9
SCHEMBL30486840 0.82 ALDH1A1 (0.64) ALDH1A1HTR1AMEN1KMT2ACYP1A2
SCHEMBL29163155 0.82 ALDH1A1 (0.64) ALDH1A1HTR1AMEN1KMT2ACYP1A2
SCHEMBL812683 0.79 ALDH1A1 (0.75) L3MBTL1ALDH1A1CA12CA9CA2
SCHEMBL14039393 0.78 ALDH1A1 (0.69) L3MBTL1MBTD1ALDH1A1CA12CA9
SCHEMBL7094852 0.78 ALDH1A1 (0.79) L3MBTL1MBTD1ALDH1A1CA12CA9
SCHEMBL7201051 0.78 ALDH1A1 (0.86) L3MBTL1MBTD1ALDH1A1CA12CA9
SCHEMBL7095193 0.77 ALDH1A1 (0.77) L3MBTL1MBTD1ALDH1A1CA12CA9
SCHEMBL7093365 0.77 ALDH1A1 (0.77) L3MBTL1MBTD1ALDH1A1CA12CA9
SCHEMBL7092896 0.77 ALDH1A1 (0.77) L3MBTL1MBTD1ALDH1A1CA12CA9

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
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