SCHEMBL2059355

SCHEMBL2059355

Cc1cc(C)c(OCC(=O)O)c(C)c1

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A2 P19784 1/20 0.49
▸ CSNK2B P67870 1/20 0.49
▸ CSNK2A1 P68400 1/20 0.49
▸ MCL1 Q07820 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ CD69 Q07108 3/20 0.46
▸ HPGD P15428 1/20 0.46
▸ PTPRB P23467 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ ELANE P08246 1/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ PTGDR2 Q9Y5Y4 1/20 0.44
▸ MEN1 O00255 1/20 0.43

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
SCHEMBL14883883 0.87 KDM4E (0.51) CSNK2A2CSNK2BCSNK2A1MCL1MAPT
SCHEMBL2058911 0.86 THRA (0.47) MCL1CD69HPGDPTPRBHSD17B10
SCHEMBL14931907 0.84 MCL1 (0.45) CSNK2A2CSNK2BCSNK2A1MCL1CD69
SCHEMBL8240454 0.84 MCL1 (0.45) MCL1CD69HPGDPTPRBHSD17B10
SCHEMBL11570516 0.84 KDM4E (0.55) MCL1MAPTHPGDKMT2AKDM4E
SCHEMBL3201351 0.84 KMT2A (0.55) MCL1CD69HPGDPTPRBHSD17B10
SCHEMBL2059557 0.84 AGBL2 (0.46) MCL1CD69HPGDPTPRBHSD17B10
SCHEMBL14997055 0.83 MAPT (0.47) MAPTHPGDHSD17B10KMT2AKDM4E
SCHEMBL11332162 0.82 HSD17B10 (0.46) MCL1CD69HPGDPTPRBHSD17B10
SCHEMBL6165860 0.82 HSD17B10 (0.56) MCL1CD69HPGDPTPRBHSD17B10

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2890677-B1 N-ACYLHYDRAZONE DERIVATIVES FOR SELECTIVE T CELL INHIBITOR AND ANTI-LYMPHOID MALIGNANCY DRUG CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2017-11-15 — — EP disclosed
US-9447083-B2 N-acylhydrazone derivatives for selective T cell inhibitor and anti-lymphoid malignancy drug CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2016-09-20 — — US disclosed
US-20150252030-A1 N-ACYLHYDRAZONE DERIVATIVES FOR SELECTIVE T CELL INHIBITOR AND ANTI-LYMPHOID MALIGNANCY DRUG CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2015-09-10 — — US disclosed
EP-2890677-A1 N-ACYLHYDRAZONE DERIVATIVES FOR SELECTIVE T CELL INHIBITOR AND ANTI-LYMPHOID MALIGNANCY DRUG Chong Kun Dang Pharmaceutical Corp. (KR) 2015-07-08 — — EP disclosed
US-8975411-B2 Therapeutic agent for neurological diseases NEUGEN PHARMA INC. (JP) 2015-03-10 — — US disclosed
EP-2599776-B1 THERAPEUTIC AGENT FOR NEUROLOGICAL DISEASES NEUGEN PHARMA INC (JP) 2014-10-15 — — EP disclosed
WO-2014035149-A1 N-ACYLHYDRAZONE DERIVATIVES FOR SELECTIVE T CELL INHIBITOR AND ANTI-LYMPHOID MALIGNANCY DRUG CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2014-03-06 — — WO disclosed
US-20130190363-A1 THERAPEUTIC AGENT FOR NEUROLOGICAL DISEASES WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 2013-07-25 — — US disclosed
EP-2599776-A1 THERAPEUTIC AGENT FOR NEUROLOGICAL DISEASES Neugen Pharma Inc. (JP) 2013-06-05 — — EP disclosed
US-7968707-B2 Reacting an amino, hydroxy substituted amide with a heterocyclic substituted carboxylic acid to produce (2S,3S,5S)-2-(2,6-Dimethylphenoxyacetyl) amino-3-hydroxy-5-[2S-1-imidazolidin-2-onyl)-3-methyl-butanoyl] amino-1,6-diphenylhexane; inhibitors of HIV infection ABBOTT LABORATORIES (US) 2011-06-28 — — US disclosed
CN-1314906-A Salts of paroxetine SMITHKLINE BEECHAM PLC (GB) 2001-09-26 — — CN disclosed
US-6284767-B1 AIDS; MIXTURE WITH ENZYME INHIBITOR ABBOTT LABORATORIES 2001-09-04 — — US disclosed
US-5914332-A NOVEL COMPOUNDS FOR USE AS HIV PROTEASE INHIBITORS IN TREATING HIV AND AIDS ABBOTT LABORATORIES (US) 1999-06-22 — — US disclosed
US-5905068-A Retroviral protease inhibiting compounds ABBOTT LABORATORIES (US) 1999-05-18 — — US disclosed
EP-0882024-A1 RETROVIRAL PROTEASE INHIBITING COMPOUNDS Abbott Laboratories (US) 1998-12-09 — — EP disclosed
EP-0876353-A1 RETROVIRAL PROTEASE INHIBITING COMPOUNDS Abbott Laboratories (US) 1998-11-11 — — EP disclosed
WO-1997021683-A1 RETROVIRAL PROTEASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1997-06-19 — — WO disclosed
WO-1997021685-A1 RETROVIRAL PROTEASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1997-06-19 — — WO disclosed
US-4672065-A TOMATO LATE BLIGHT CHEVRON RESEARCH COMPANY (US) 1987-06-09 — — US disclosed
US-4535087-A FOR TOMATO LATE BLIGHT CHEVRON RESEARCH COMPANY (US) 1985-08-13 — — 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 (2 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-20130190363-A1 THERAPEUTIC AGENT FOR NEUROLOGICAL DISEASES AIFM1, AIFM2, GPX4 CSNK2A2 709/4885CSNK2B 1095/4885CSNK2A1 688/4885
US-20150252030-A1 N-ACYLHYDRAZONE DERIVATIVES FOR SELECTIVE T CELL INHIBITOR AND ANTI-LYMPHOID MALIGNANCY DRUG MALT1, MCL1, ACIN1 CSNK2A2 1380/4885CSNK2B 924/4885CSNK2A1 1234/4885

“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.

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