SCHEMBL3766090

SCHEMBL3766090

O=C(CCc1ccccc1)NCCc1ccc(NS(=O)(=O)O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.56
HPGD P15428 2/20 0.56
HDAC1 Q13547 3/20 0.54
HDAC8 Q9BY41 3/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
HDAC4 P56524 2/20 0.54
HDAC3 O15379 2/20 0.54
HDAC2 Q92769 2/20 0.54
HDAC10 Q969S8 2/20 0.54
HDAC11 Q96DB2 2/20 0.54
HDAC6 Q9UBN7 2/20 0.54
NCOR2 Q9Y618 2/20 0.54
HDAC9 Q9UKV0 1/20 0.54
HTT P42858 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.51
RAB9A P51151 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA5A P35218 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
SCHEMBL2186352 0.83 HDAC2 (0.72) HPGDHDAC1HDAC8MEN1KMT2A
SCHEMBL12470057 0.81 ACACB (0.50) HPGDHTTCA1CA2
SCHEMBL12246765 0.80 TAAR1 (0.56) HPGDHDAC1HDAC8MEN1KMT2A
SCHEMBL4151976 0.79 GAA (0.74) HPGDHDAC1HDAC8MEN1KMT2A
SCHEMBL4151866 0.79 GAA (0.74) HPGDHDAC1HDAC8MEN1KMT2A
SCHEMBL13401878 0.79 CA1 (0.80) CA1CA2CA5ACA7CA5B
SCHEMBL28153879 0.79 ALDH1A1 (0.61) PTPN1HDAC1HDAC8HDAC4CA1
SCHEMBL6803371 0.78 CNR1 (0.58) MEN1KMT2AHTTPOLB
SCHEMBL7765076 0.78 L3MBTL1 (0.79) HPGDHDAC1HDAC8HDAC4HDAC3
SCHEMBL15679869 0.78 PLAAT3 (0.73) HPGDHDAC1HDAC8KMT2AHDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200361926-A1 COMPOSITIONS, FORMULATIONS AND METHODS FOR TREATING OCULAR DISEASES EyePoint Pharmaceuticals, Inc. 2020-11-19 US disclosed
US-10463650-B2 Human protein tyrosine phosphatase inhibitors and methods of use Aerpio Pharmaceuticals, Inc. (US) 2019-11-05 US disclosed
US-20180237431-A1 COMPOSITIONS, FORMULATIONS AND METHODS FOR TREATING OCULAR DISEASES EyePoint Pharmaceuticals, Inc. 2018-08-23 US disclosed
US-20180237429-A1 COMPOSITIONS, FORMULATIONS AND METHODS FOR TREATING OCULAR DISEASES EyePoint Pharmaceuticals, Inc. 2018-08-23 US disclosed
US-20180221346-A1 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE EyePoint Pharmaceuticals, Inc. 2018-08-09 US disclosed
US-20180022741-A1 COMPOSITIONS, FORMULATIONS AND METHODS FOR TREATING OCULAR DISEASES EyePoint Pharmaceuticals, Inc. 2018-01-25 US disclosed
US-9795594-B2 Human protein tyrosine phosphatase inhibitors and methods of use AERPIO THERAPEUTICS, INC. (US) 2017-10-24 US disclosed
US-20160374996-A1 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE EyePoint Pharmaceuticals, Inc. 2016-12-29 US disclosed
US-20160220540-A1 COMPOSITIONS, FORMULATIONS AND METHODS FOR TREATING OCULAR DISEASES EyePoint Pharmaceuticals, Inc. 2016-08-04 US disclosed
EP-2967066-A1 COMPOSITIONS, FORMULATIONS AND METHODS FOR TREATING OCULAR DISEASES Aerpio Therapeutics Inc. (US) 2016-01-20 EP disclosed
US-20150210656-A1 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE EyePoint Pharmaceuticals, Inc. 2015-07-30 US disclosed
WO-2014145068-A1 COMPOSITIONS, FORMULATIONS AND METHODS FOR TREATING OCULAR DISEASES AERPIO THERAPEUTICS INC. (US) 2014-09-18 WO disclosed
EP-2624916-A2 COMPOSITIONS AND METHODS FOR TREATING OCULAR EDEMA, NEOVASCULARIZATION AND RELATED DISEASES Aerpio Therapeutics Inc. (US) 2013-08-14 EP disclosed
WO-2012047966-A2 COMPOSITIONS AND METHODS FOR TREATING OCULAR EDEMA, NEOVASCULARIZATION AND RELATED DISEASES AKEBIA THERAPEUTICS INC. (US) 2012-04-12 WO disclosed
US-20100016336-A1 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE EyePoint Pharmaceuticals, Inc. 2010-01-21 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 (10 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-20100016336-A1 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE PTPRCAP, PTPRC, PPP5C PTPN1 62/4885HPGD 2697/4885HDAC1 2399/4885
US-10463650-B2 Human protein tyrosine phosphatase inhibitors and methods of use PTPRCAP, PTPRC, PPP5C PTPN1 62/4885HPGD 2697/4885HDAC1 2399/4885
US-20180237429-A1 COMPOSITIONS, FORMULATIONS AND METHODS FOR TREATING OCULAR DISEASES TIE1, TEK, KDR PTPN1 2139/4885HPGD 584/4885HDAC1 3177/4885
US-20180237431-A1 COMPOSITIONS, FORMULATIONS AND METHODS FOR TREATING OCULAR DISEASES TIE1, TEK, KDR PTPN1 2139/4885HPGD 584/4885HDAC1 3177/4885
US-20160220540-A1 COMPOSITIONS, FORMULATIONS AND METHODS FOR TREATING OCULAR DISEASES TIE1, TEK, KDR PTPN1 2139/4885HPGD 584/4885HDAC1 3177/4885
US-20180022741-A1 COMPOSITIONS, FORMULATIONS AND METHODS FOR TREATING OCULAR DISEASES TIE1, TEK, KDR PTPN1 2139/4885HPGD 584/4885HDAC1 3177/4885
US-20200361926-A1 COMPOSITIONS, FORMULATIONS AND METHODS FOR TREATING OCULAR DISEASES TIE1, TEK, KDR PTPN1 2139/4885HPGD 584/4885HDAC1 3177/4885
US-20180221346-A1 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE PTPRCAP, PTPRC, PPP5C PTPN1 62/4885HPGD 2697/4885HDAC1 2399/4885
US-20150210656-A1 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE PTPRCAP, PTPRC, PPP5C PTPN1 62/4885HPGD 2697/4885HDAC1 2399/4885
US-20160374996-A1 HUMAN PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE PTPRCAP, PTPRC, PPP5C PTPN1 62/4885HPGD 2697/4885HDAC1 2399/4885

“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.