SCHEMBL5963342

SCHEMBL5963342

Cc1cc(C)c(S(=O)(=O)NCCCCNS(=O)(=O)c2c(C)cc(C)cc2C)c(C)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 2/20 0.76
L3MBTL1 Q9Y468 2/20 0.63
LMNA P02545 2/20 0.60
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
MAPT P10636 3/20 0.57
GAA P10253 2/20 0.57
ALOX12 P18054 1/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
MMP1 P03956 1/20 0.57
MMP2 P08253 1/20 0.57
MMP9 P14780 1/20 0.57
MMP8 P22894 1/20 0.57
MMP13 P45452 1/20 0.57
NR2F2 P24468 1/20 0.54
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
POLB P06746 2/20 0.51
FGB P02675 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
SCHEMBL4746858 0.93 FABP4 (0.68) FABP4L3MBTL1LMNAMEN1KMT2A
SCHEMBL5562243 0.92 L3MBTL1 (0.67) FABP4L3MBTL1LMNAMEN1KMT2A
SCHEMBL4747454 0.91 FABP4 (0.66) FABP4L3MBTL1LMNAMEN1KMT2A
SCHEMBL8576092 0.91 MAPT (0.69) FABP4L3MBTL1LMNAMEN1KMT2A
SCHEMBL7511658 0.87 FABP4 (0.61) FABP4L3MBTL1LMNAMEN1KMT2A
SCHEMBL11560895 0.87 FABP4 (0.61) FABP4L3MBTL1LMNAMEN1KMT2A
SCHEMBL7517048 0.87 FABP4 (0.61) FABP4L3MBTL1LMNAMEN1KMT2A
SCHEMBL3687291 0.86 L3MBTL1 (0.61) FABP4L3MBTL1LMNAMEN1KMT2A
SCHEMBL18553817 0.86 CA2 (0.60) FABP4L3MBTL1LMNAMEN1KMT2A
SCHEMBL11495820 0.86 FABP4 (0.59) FABP4L3MBTL1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200390896-A1 Polyamine Prodrugs And Polyamine Prodrug Formulations UNIV NEBRASKA (US) 2020-12-17 US claimed
WO-2019173446-A1 POLYAMINE PRODRUGS AND POLYAMINE PRODRUG FORMULATIONS BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 2019-09-12 WO claimed
US-20200390896-A1 Polyamine Prodrugs And Polyamine Prodrug Formulations UNIV NEBRASKA (US) 2020-12-17 US disclosed
US-20130137772-A1 HYDROXYPOLYAMINE SALTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2013-05-30 US disclosed
US-7094808-B2 Analogs of biologically active, naturally occurring polyamines, pharmaceutical compositions and methods of treatment UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2006-08-22 US disclosed
US-20040131574-A1 Method and composition for the control of hair growth FLORIDA, UNIVERSITY OF 2004-07-08 US disclosed
US-20030100615-A1 Analogs of biologically active, naturally occurring polyamines, pharmaceutical compositions and methods of treatment BERGERON RAYMOND J (US) 2003-05-29 US disclosed
US-20020143068-A1 Analogs of biologically active, naturally occurring polyamines, pharmaceutical compositions and methods of treatment BERGERON RAYMOND J (US) 2002-10-03 US disclosed
WO-2002062341-A1 METHOD AND COMPOSITION FOR THE CONTROL OF HAIR GROWTH UNIVERSITY OF FLORIDA (US) 2002-08-15 WO disclosed
US-20020045780-A1 Biologically active spermidine analogues, pharmaceutical compositions and methods of treatment BERGERON RAYMOND J (US) 2002-04-18 US disclosed
US-6342534-B1 BRIDGING GROUPS MAINTAIN DISTANCE BETWEEN NITROGEN ATOMS BINDING VIA ELECTROSTATIC INTERACTION TO COUNTER-ANIONS; ANTITUMOR,ANTICARCINOGENIC AGENTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2002-01-29 US disclosed
US-6235794-B1 ANTICANCER AGENT UNIVERSITY OF FLORIDA 2001-05-22 US disclosed
US-6184232-B1 AMINE ADDUCT WHICH COMPETETIVELY BINDS WITH TARGET CELL COUNTERION AND FUNCTIONS DIFFERENTLY COMPARED TO NATURAL INTRACELLULAR POLYAMINES; ANTICARCINOGENIC AGENTS UNIVERSITY OF FLORIDA 2001-02-06 US disclosed
US-5886051-A MODULATORS OF THE N-METHYLASPARTIC ACID RECEPTOR; AGONISTS AND ANTAGONISTS; ALZHEIMER'S DISEASE; COGNITION ACTIVATORS; ACYCLIC AND CYCLIC COMPOUNDS HAVING TWO OR MORE SECONDARY AMINES UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 1999-03-23 US 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 (6 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-20040131574-A1 Method and composition for the control of hair growth ODC1, OTC, OAT FABP4 1715/4885L3MBTL1 2888/4885LMNA 3247/4885
US-20030100615-A1 Analogs of biologically active, naturally occurring polyamines, pharmaceutical compositions and methods of treatment SLC7A1, SRM, SLC1A5 FABP4 3950/4885L3MBTL1 2888/4885LMNA 1538/4885
US-20020045780-A1 Biologically active spermidine analogues, pharmaceutical compositions and methods of treatment SRM, SLC7A1, CATSPER1 FABP4 3667/4885L3MBTL1 3921/4885LMNA 3705/4885
US-20130137772-A1 HYDROXYPOLYAMINE SALTS ALK, ALKBH3, HRH3 FABP4 3785/4885L3MBTL1 2607/4885LMNA 3109/4885
US-20020143068-A1 Analogs of biologically active, naturally occurring polyamines, pharmaceutical compositions and methods of treatment SLC7A1, SRM, SLC1A5 FABP4 3950/4885L3MBTL1 2888/4885LMNA 1538/4885
US-20200390896-A1 Polyamine Prodrugs And Polyamine Prodrug Formulations SRM, SMS, S1PR1 FABP4 4695/4885L3MBTL1 1737/4885LMNA 1827/4885

“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.