SCHEMBL50370

SCHEMBL50370

[O]N(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.48
NPSR1 Q6W5P4 2/20 0.48
ALOX15 P16050 1/20 0.48
KMT2A Q03164 4/20 0.46
HTT P42858 3/20 0.46
MEN1 O00255 3/20 0.46
ATM Q13315 3/20 0.40
HPGD P15428 2/20 0.40
HSP90AA1 P07900 1/20 0.40
XBP1 P17861 1/20 0.40
ALOX12 P18054 1/20 0.40
RUNX1 Q01196 1/20 0.40
CBFB Q13951 1/20 0.40
L3MBTL1 Q9Y468 4/20 0.39
TDP1 Q9NUW8 2/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL8906992 0.78 RAB9A (0.49) ALDH1A1NPSR1KMT2AHTTMEN1
SCHEMBL8907181 0.74 POLB (0.40) ALDH1A1NPSR1ALOX15KMT2AHTT
SCHEMBL8000199 0.73
SCHEMBL453160 0.69 ALDH1A1 (0.67) ALDH1A1NPSR1ALOX15KMT2AHTT
SCHEMBL301494 0.69 ALDH1A1 (0.45) ALDH1A1NPSR1ALOX15KMT2AHTT
SCHEMBL30959 0.69 ALDH1A1 (0.67) ALDH1A1NPSR1ALOX15KMT2AHTT
SCHEMBL9490577 0.69 ALDH1A1 (0.67) ALDH1A1NPSR1ALOX15KMT2AHTT
SCHEMBL5942990 0.67 MEN1 (0.42) ALDH1A1NPSR1ALOX15KMT2AHTT
SCHEMBL129629 0.67 PKM (0.56) ALDH1A1NPSR1ALOX15KMT2AHTT
Bicarbonate SCHEMBL6732703 0.67 NPSR1 (0.57) ALDH1A1NPSR1ALOX15KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3458522-B1 PROCESS FOR THE PREPARATION OF DIAMINOPHENOTHIAZINIUM COMPOUNDS HAVING A HIGH DEGREE OF PURITY ICROM SPA (IT) 2024-01-03 EP claimed
US-10723710-B2 Process for the preparation of diaminophenothiazinium compounds having a high degree of purity ICROM S.P.A. (IT) 2020-07-28 US claimed
CN-106661161-B Process for preparing diene polymers or random vinyl arene-diene copolymers 维尔萨利斯股份公司 2020-03-24 CN claimed
US-20190185440-A1 PROCESS FOR THE PREPARATION OF DIAMINOPHENOTHIAZINIUM COMPOUNDS HAVING A HIGH DEGREE OF PURITY ICROM S.P.A. (IT) 2019-06-20 US claimed
US-10253116-B2 Process for the preparation of diene polymers or random vinyl arene-diene copolymers VERSALIS S.P.A. (IT) 2019-04-09 US claimed
EP-3458522-A1 PROCESS FOR THE PREPARATION OF DIAMINOPHENOTHIAZINIUM COMPOUNDS HAVING A HIGH DEGREE OF PURITY Icrom SpA (IT) 2019-03-27 EP claimed
US-10150730-B2 Process for preparing α-damascone BASF SE (DE) 2018-12-11 US claimed
US-20180244613-A1 PROCESS FOR PREPARING ALPHA-DAMASCONE BASF SE (DE) 2018-08-30 US claimed
EP-3183280-B1 PROCESS FOR THE PREPARATION OF DIENE POLYMERS OR RANDOM VINYL ARENE-DIENE COPOLYMERS VERSALIS SPA (IT) 2018-07-04 EP claimed
EP-3337781-A1 PROCESS FOR PREPARING ALPHA-DAMASCONE BASF SE (DE) 2018-06-27 EP claimed
CN-1821207-A Composite polymerzation inhibitor for producing methyl propenoic acid and its ester HUAYI PROPENOIC ACID CO LTD SH (CN) 2006-08-23 CN claimed
EP-1606372-A1 DIESEL FUEL COMPOSITION AND A METHOD TO IMPROVE FILTERABILITY OF DIESEL FUEL Ciba SC Holding AG (CH) 2005-12-21 EP claimed
EP-1590383-A2 PRESSURE-SENSITIVE ADHESIVE TAPE FOR THE ADHESION OF PRINTING PLATES AND METHOD FOR THE PRODUCTION THEREOF Tesa AG (DE) 2005-11-02 EP claimed
US-20040216370-A1 Diesel fuel composition and a method to improve filterability of diesel fuel CIBA SPECIALTY CHEMICALS CORP. 2004-11-04 US claimed
WO-2004087841-A1 DIESEL FUEL COMPOSITION AND A METHOD TO IMPROVE FILTERABILITY OF DIESEL FUEL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-10-14 WO claimed
WO-2004067661-A2 TWO-STAGE FREE-RADICAL POLYMERIZATION METHOD FOR THE PRODUCTION OF PRESSURE-SENSITIVE ADHESIVES FOR PRESSURE-SENSITIVE ADHESIVE TAPES USED FOR BONDING PRINTING PLATES TESA AG (DE) 2004-08-12 WO claimed
WO-2004056331-A1 COMPOSITION FOR DYEING KERATIN FIBRES, COMPRISING AT LEAST ONE FREE-RADICAL COMPOUND OF NITROXYL TYPE AND AT LEAST ONE PRIMARY OR SECONDARY ALCOHOL L'OREAL (FR) 2004-07-08 WO claimed
EP-0822835-A1 HYBRID MAGNETIC RESONANCE CONTRAST AGENTS IMARX PHARMACEUTICAL CORP. (US) 1998-02-11 EP claimed
WO-1996032967-A1 HYBRID MAGNETIC RESONANCE CONTRAST AGENTS IMARX PHARMACEUTICAL CORPORATION (US) 1996-10-24 WO claimed
US-5407657-A Containing a metal chelate and a free radical nitroxide IMARX THERAPEUTICS, INC. 1995-04-18 US claimed

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

For each of this compound's patents that has machine-readable text (4 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-10723710-B2 Process for the preparation of diaminophenothiazinium compounds having a high degree of purity DDT, QDPR, DDC ALDH1A1 1676/4885NPSR1 3690/4885ALOX15 3939/4885
US-20180244613-A1 PROCESS FOR PREPARING ALPHA-DAMASCONE ADH1C, TALDO1, NOS1 ALDH1A1 15/4885NPSR1 2453/4885ALOX15 237/4885
US-10150730-B2 Process for preparing α-damascone NOS1, ADH1C, ADH1A ALDH1A1 8/4885NPSR1 2213/4885ALOX15 196/4885
US-20190185440-A1 PROCESS FOR THE PREPARATION OF DIAMINOPHENOTHIAZINIUM COMPOUNDS HAVING A HIGH DEGREE OF PURITY DDT, QDPR, DDC ALDH1A1 1676/4885NPSR1 3690/4885ALOX15 3939/4885

“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.