SCHEMBL7093365

SCHEMBL7093365

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

nearest known ligand 0.77

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 15/20 0.77
CA12 O43570 1/20 0.72
CA2 P00918 1/20 0.72
CA9 Q16790 1/20 0.72
ALOX15 P16050 1/20 0.70
HTT P42858 1/20 0.69
MEN1 O00255 2/20 0.68
KMT2A Q03164 2/20 0.68
LMNA P02545 3/20 0.68
PKM P14618 3/20 0.67
KDM4E B2RXH2 1/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
MBTD1 Q05BQ5 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64

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
SCHEMBL7092896 1.00 ALDH1A1 (0.77) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL7095731 1.00 ALDH1A1 (0.77) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL7095949 1.00 ALDH1A1 (0.77) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL7095193 1.00 ALDH1A1 (0.77) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL7097551 1.00 ALDH1A1 (0.77) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL7094852 0.98 ALDH1A1 (0.79) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL7201051 0.94 ALDH1A1 (0.86) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL7103280 0.93 ALDH1A1 (0.72) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL634183 0.93 ALDH1A1 (0.72) ALDH1A1CA12CA2CA9ALOX15
SCHEMBL8355315 0.93 ALDH1A1 (0.72) 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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8420626-B2 Arene connected polyamine macrocyclic derivatives, preparation methods and pharmaceutical uses thereof BEIJING MOLECULE SCIENCE AND TECHNOLOGY CO., LTD. (CN) 2013-04-16 US disclosed
US-20100179116-A1 Arene Connected Polyamine Macrocyclic Derivatives, Preparation Methods and Pharmaceutical Uses Thereof BEIJING MOLECULE SCIENCE AND TECHNOLOGY CO., LTD. (CN) 2010-07-15 US disclosed
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
EP-0497202-B1 Polyamine thiols as radioprotective agents MERRELL DOW PHARMA (US) 1995-09-13 EP disclosed
EP-0495450-B1 Polyamine phenols as radioprotective agents MERRELL DOW PHARMA (US) 1995-07-26 EP disclosed
EP-0662829-A1 POLYAMINE DERIVATIVES AS ANTI-CYTOMEGALOVIRAL AGENTS MERRELL PHARMACEUTICALS INC. (US) 1995-07-19 EP disclosed
US-5354782-A Polyamine phenols as radioprotective agents MERRELL DOW PHARMACEUTICALS INC. (US) 1994-10-11 US disclosed
WO-1994007480-A1 POLYAMINE DERIVATIVES AS ANTI-CYTOMEGALOVIRAL AGENTS MERRELL DOW PHARMACEUTICALS INC. (US) 1994-04-14 WO disclosed
US-5217964-A POLYAMINE THIOLS AS RADIOPROTECTIVE AGENTS MERRELL DOW PHARMACEUTICALS INC. (US) 1993-06-08 US disclosed
EP-0497202-A1 Polyamine thiols as radioprotective agents MERRELL DOW PHARMACEUTICALS INC. (US) 1992-08-05 EP disclosed
EP-0495450-A2 Polyamine phenols as radioprotective agents MERRELL DOW PHARMACEUTICALS INC. (US) 1992-07-22 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100179116-A1 Arene Connected Polyamine Macrocyclic Derivatives, Preparation Methods and Pharmaceutical Uses Thereof SRM, SP1, SMS ALDH1A1 1826/4885CA12 4689/4885CA2 4341/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.