SCHEMBL4463024

SCHEMBL4463024

C=CCn1[c]c(C#N)cn1

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HPGD P15428 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
GAA P10253 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL11032708 0.62 CYP3A4 (0.34) CYP3A4
SCHEMBL2076292 0.60 PKM (0.51) KDM4EL3MBTL1HPGDMEN1KMT2A
SCHEMBL10706636 0.58 SLC6A2 (0.33) KDM4EL3MBTL1HPGDMEN1KMT2A
SCHEMBL4591384 0.56
SCHEMBL1140198 0.56
SCHEMBL10428745 0.56 MAPT (0.35) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL10867547 0.56 KDM4E (0.35) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL19986390 0.55 KDM4E (0.35) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL4214340 0.54
SCHEMBL10824003 0.54 KDM4E (0.42) KDM4EL3MBTL1MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0492444-B1 Novel synthesis of pyrazole dyes EASTMAN KODAK CO (US) 1996-11-27 EP claimed
US-5144015-A Diazotization, salt formation, coupling, and alkylation to form 1-alkyl-3-alkyl or aryl-4-cyanopyrazol-5-yl azo dye EASTMAN KODAK COMPANY (US) 1992-09-01 US claimed
EP-0492444-A1 Novel synthesis of pyrazole dyes EASTMAN KODAK COMPANY (US) 1992-07-01 EP claimed
US-7572911-B2 Azo compound and process of producing the same, and novel compound and process of producing azo compounds using the same FUJIFILM CORPORATION (JP) 2009-08-11 US disclosed
US-20070173641-A1 Azo compound and process of producing the same, and novel compound and process of producing azo compounds using the same FUJI PHOTO FILM CO., LTD. 2007-07-26 US disclosed
US-7109336-B2 Azo compound and process of producing the same, and novel compound and process of producing azo compounds using the same FUJI PHOTO FILM CO., LTD. (JP) 2006-09-19 US disclosed
US-20040122219-A1 Azo compound and process of producing the same, and novel compound and process of producing azo compounds using the same FUJIFILM CORPORATION (JP) 2004-06-24 US disclosed
EP-1377640-A2 AZO COMPOUNDS AND PROCESS OF PRODUCING THE SAME AND NOVEL INTERMEDIATE COMPOUNDS USED IN THE PROCESS OF PRODUCING AZO COMPOUNDS FUJI PHOTO FILM CO., LTD. (JP) 2004-01-07 EP disclosed
US-6613888-B2 Having good hue and capable of forming images having high lightfastness FUJI PHOTO FILM CO., LTD. (JP) 2003-09-02 US disclosed
US-20030040608-A1 Azo dyes, process for making the same, ink-jet printing ink, ink-jet recording method FUJIFILM CORPORATION (JP) 2003-02-27 US disclosed
US-6489452-B1 AN AZO DYE REPRESENTED BY THE FOLLOWING GENERAL FORMULA (1) AND A PROCESS FOR MAKING THE AZO DYE IS DISCLOSED. THE PROCESS COMPRISES A STEP IN WHICH A DIAZONIUM SALT IS FORMED BY THE REACTION BETWEEN AN AMINOPYRAZOLE AND AROMATIC COUPLING AGENT FUJI PHOTO FILM CO., LTD. (JP) 2002-12-03 US disclosed
WO-2002083662-A2 AZO COMPOUNDS AND PROCESS OF PRODUCING THE SAME AND NOVEL INTERMEDIATE COMPOUNDS USED IN THE PROCESS OF PRODUCING AZO COMPOUNDS FUJI PHOTO FILM CO., LTD. (JP) 2002-10-24 WO disclosed
US-6455679-B1 HETERYLANILINE AZO DYES FUJI PHOTO FILM CO., LTD. (JP) 2002-09-24 US disclosed
US-20020049310-A1 Azo dye, ink-jet recording ink containing the same, and ink-jet recording method FUJIFILM CORPORATION (JP) 2002-04-25 US disclosed
EP-0492444-B1 Novel synthesis of pyrazole dyes EASTMAN KODAK CO (US) 1996-11-27 EP disclosed
US-5144015-A Diazotization, salt formation, coupling, and alkylation to form 1-alkyl-3-alkyl or aryl-4-cyanopyrazol-5-yl azo dye EASTMAN KODAK COMPANY (US) 1992-09-01 US disclosed
US-5144015-A Diazotization, salt formation, coupling, and alkylation to form 1-alkyl-3-alkyl or aryl-4-cyanopyrazol-5-yl azo dye EASTMAN KODAK COMPANY (US) 1992-09-01 US disclosed
EP-0492444-A1 Novel synthesis of pyrazole dyes EASTMAN KODAK COMPANY (US) 1992-07-01 EP disclosed
EP-0492444-A1 Novel synthesis of pyrazole dyes EASTMAN KODAK COMPANY (US) 1992-07-01 EP 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-20070173641-A1 Azo compound and process of producing the same, and novel compound and process of producing azo compounds using the same CYP4A11, CYP4F11, CYP4X1 KDM4E 843/4885L3MBTL1 4878/4885HPGD 1210/4885

“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.