SCHEMBL158106

SCHEMBL158106

CCCCOC(=O)N=NC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
ATM Q13315 1/20 0.47
HCAR2 Q8TDS4 3/20 0.46
TSHR P16473 5/20 0.44
HPGD P15428 1/20 0.44
NAAA Q02083 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
EPHX1 P07099 1/20 0.38
LMNA P02545 1/20 0.38
ESR1 P03372 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAPK1 P28482 1/20 0.38
CYP2C19 P33261 1/20 0.38
NR1H2 P55055 1/20 0.38
RNASEL Q05823 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ACHE P22303 6/20 0.37

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
SCHEMBL16114719 1.00 ALDH1A1 (0.50) ALDH1A1ATMHCAR2TSHRHPGD
SCHEMBL1971178 1.00 ALDH1A1 (0.50) ALDH1A1ATMHCAR2TSHRHPGD
SCHEMBL15865201 0.94 NAAA (0.48) ALDH1A1ATMHCAR2TSHRNAAA
SCHEMBL15864900 0.92 NAAA (0.52) ALDH1A1HCAR2TSHRNAAAEPHX1
SCHEMBL15864530 0.92 NAAA (0.52) ALDH1A1HCAR2TSHRNAAAEPHX1
SCHEMBL15864524 0.92 NAAA (0.52) ALDH1A1HCAR2TSHRNAAAEPHX1
SCHEMBL843522 0.91 ALDH1A1 (0.58) ALDH1A1ATMHCAR2TSHRHPGD
SCHEMBL158105 0.91 ALDH1A1 (0.58) ALDH1A1ATMHCAR2TSHRHPGD
SCHEMBL15843513 0.87 ALDH1A1 (0.54) ALDH1A1ATMHCAR2TSHRHPGD
SCHEMBL15843351 0.87 ALDH1A1 (0.54) ALDH1A1ATMHCAR2TSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4326709-A1 METHODS OF SYNTHESIZING LIPSTATIN DERIVATIVES Panafina, Inc. (US) 2024-02-28 EP claimed
CN-111056968-B Preparation method of benorilate 广西科技大学 2023-04-14 CN claimed
EP-3606922-A1 CONJUGATION OF A CYTOTOXIC DRUG WITH BIS-LINKAGE Hangzhou Dac Biotech Co., Ltd (CN) 2020-02-12 EP claimed
WO-2018185526-A1 CONJUGATION OF A CYTOTOXIC DRUG WITH BIS-LINKAGE HANGZHOU DAC BIOTECH CO., LTD (CN) 2018-10-11 WO claimed
EP-3337789-A1 PROCESS FOR PREPARATION OF VORTIOXETINE HYDROBROMIDE Amneal Pharmaceuticals Company GmbH (CH) 2018-06-27 EP claimed
WO-2017029377-A1 PROCESS FOR PREPARATION OF VORTIOXETINE HYDROBROMIDE AMNEAL PHARMACEUTICALS COMPANY GMBH (CH) 2017-02-23 WO claimed
WO-2014108795-A2 AN IMPROVED PROCESS FOR THE PREPARATION OF CHIRAL DIOL SULFONES AND STATINS AUROBINDO PHARMA LIMITED (IN) 2014-07-17 WO claimed
WO-2013072903-A1 NITROIMIDAZOXADIAZOCINE COMPOUNDS ITHEMBA PHARMACEUTICALS (PROPRIETARY) LIMITED (ZA) 2013-05-23 WO claimed
EP-2560939-A2 NOVEL PROCESS FOR PREPARING PHENYLCYCLOPROPYLAMINE DERIVATIVES USING NOVEL INTERMEDIATES Actavis Group Ptc Ehf (IS) 2013-02-27 EP claimed
WO-2011132083-A2 NOVEL PROCESS FOR PREPARING PHENYLCYCLOPROPYLAMINE DERIVATIVES USING NOVEL INTERMEDIATES ACTAVIS GROUP PTC EHF (IS) 2011-10-27 WO claimed
EP-1758866-A1 PROCESSES FOR PREPARING 6-ALKYL-5-ARYLSULFONYL- DIHYDROPHENANTHRIDINES Wyeth (US) 2007-03-07 EP claimed
WO-2006009831-A1 PROCESSES FOR PREPARING 6-ALKYL-5-ARYLSULFONYL- DIHYDROPHENANTHRIDINES WYETH (US) 2006-01-26 WO claimed
WO-2000001678-A1 PROCESS FOR THE SYNTHESIS OF SUBSTITUTED PIPERAZINONES VIA MITSUNOBU REACTION MERCK & CO., INC. (US) 2000-01-13 WO claimed
US-20250011326-A1 FUSED HETEROCYCLIC DERIVATIVES AND THEIR USE IN THE TREATMENT OF HBV INFECTION Janssen Sciences Ireland Unlimited Company (IE) 2025-01-09 US disclosed
WO-2024112746-A1 PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF A PYRIMIDINE AMINOPYRAZOLE COMPOUND DENALI THERAPEUTICS INC. (US) 2024-05-30 WO disclosed
EP-4373817-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER Astrazeneca AB (SE) 2024-05-29 EP disclosed
EP-0873340-A1 HETEROCYCLIC SUBSTITUTED CYCLOPENTANE COMPOUNDS Abbott Laboratories (US) 1998-10-28 EP disclosed
WO-1996040686-A1 HETEROCYCLIC SUBSTITUTED CYCLOPENTANE COMPOUNDS ABBOTT LABORATORIES (US) 1996-12-19 WO disclosed
WO-1995003300-A1 HETEROARYL QUINOLINES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS MERCK FROSST CANADA INC. (CA) 1995-02-02 WO disclosed
WO-1994005657-A1 HETEROARYLNAPHTHALENE HYDROXY ACIDS AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS MERCK FROSST CANADA INC. (CA) 1994-03-17 WO 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-20250011326-A1 FUSED HETEROCYCLIC DERIVATIVES AND THEIR USE IN THE TREATMENT OF HBV INFECTION HAVCR2, HCCS, HDGF ALDH1A1 3167/4885ATM 3579/4885HCAR2 1246/4885

“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.