SCHEMBL1655723

SCHEMBL1655723

CC1=Nc2ncccc2C1(C)C

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.34
NPC1 O15118 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MEN1 O00255 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
RECQL P46063 1/20 0.34
RAB9A P51151 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33
HSP90AA1 P07900 1/20 0.33
PDK2 Q15119 3/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL22970332 0.76 CYP1A2 (0.35) KMT2APDK2CYP1A2CYP2C19
SCHEMBL21401727 0.71 MEN1 (0.32) KMT2AMEN1
Quinoline SCHEMBL27529701 0.70 ALDH1A1 (0.52) KMT2ANPC1L3MBTL1MEN1KDM4E
SCHEMBL19978242 0.69 MEN1 (0.41) KMT2ANPC1L3MBTL1MEN1KDM4E
SCHEMBL4619322 0.68 PSMB5 (0.40) KMT2ANPC1MEN1KDM4EALDH1A1
SCHEMBL19978240 0.68 KDM4E (0.55) KMT2ANPC1L3MBTL1MEN1KDM4E
SCHEMBL19978239 0.68 MAPT (0.47) KMT2ANPC1L3MBTL1MEN1KDM4E
SCHEMBL101153 0.68 CASP3 (0.47) KMT2AL3MBTL1MEN1KDM4EALDH1A1
SCHEMBL1335900 0.67 PDK2 (0.43) KMT2ANPC1L3MBTL1MEN1KDM4E
Iodide SCHEMBL14844987 0.67 CASP3 (0.46) KMT2AL3MBTL1MEN1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116284090-A Electron acceptor and fluoboric cyanine fluorescent dye as well as preparation method and application thereof 四川大学华西医院 2023-06-23 CN disclosed
US-20210040326-A1 AZACYANINE DYES AND USE THEREOF ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2021-02-11 US disclosed
US-10633542-B2 Azacyanine dyes and use thereof Ecole polytechnique fédérale de Lausanne (EPFL) (CH) 2020-04-28 US disclosed
WO-2019180475-A1 AZACYANINE DYES AND USE THEREOF ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2019-09-26 WO disclosed
US-20190292371-A1 AZACYANINE DYES AND USE THEREOF INTRACE MEDICAL SA (CH) 2019-09-26 US disclosed
US-20180079906-A1 AZACYANINE DYES AND USE THEREOF Ecole polytechnique fédérale de Lausanne (EPFL) (CH) 2018-03-22 US disclosed
US-20180079906-A1 AZACYANINE DYES AND USE THEREOF Ecole polytechnique fédérale de Lausanne (EPFL) (CH) 2018-03-22 US disclosed
EP-2630196-B1 CYANINE DYES AND THEIR CONJUGATES LI COR INC (US) 2017-09-06 EP disclosed
EP-2630196-B1 CYANINE DYES AND THEIR CONJUGATES LI COR INC (US) 2017-09-06 EP disclosed
US-20160356681-A1 MODIFIED CARBOCYANINE DYES AND THEIR CONJUGATES Life Technologies Corporation 2016-12-08 US disclosed
US-20060099638-A1 Modified carbocyanine dyes and their conjugates MOLECULAR PROBES, INC. 2006-05-11 US disclosed
US-20060004188-A1 Intermediates and the synthesis of modified carbocyanine dyes and their conjugates MOLECULAR PROBES, INC. 2006-01-05 US disclosed
US-6977305-B2 Modified carbocyanine dyes and their conjugates MOLECULAR PROBES, INC. (US) 2005-12-20 US disclosed
US-6974873-B2 Modified carbocyanine dyes and their conjugates MOLECULAR PROBES, INC. (US) 2005-12-13 US disclosed
US-20050112770-A1 Method for optical measurement of multi-stranded nucleic acid FUJI PHOTO FILM CO., LTD. 2005-05-26 US disclosed
EP-1362894-A2 Method for optical measurement of multi-stranded nucleic acid using cyanine dyes FUJI PHOTO FILM CO., LTD. (JP) 2003-11-19 EP disclosed
EP-1322710-A1 MODIFIED CARBOCYANINE DYES AND THEIR CONJUGATES Molecular Probes Inc. (US) 2003-07-02 EP disclosed
US-20020077487-A1 Modified carbocyanine dyes and their conjugates MOLECULAR PROBES, INC. 2002-06-20 US disclosed
US-20020064794-A1 Modified carbocyanine dyes and their conjugates MOLECULAR PROBES, INC. 2002-05-30 US disclosed
WO-2002026891-A1 MODIFIED CARBOCYANINE DYES AND THEIR CONJUGATES MOLECULAR PROBES, INC. (US) 2002-04-04 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 (8 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-20020077487-A1 Modified carbocyanine dyes and their conjugates IK, CBR3, DRD5 KMT2A 2895/4885NPC1 2746/4885L3MBTL1 3018/4885
US-20210040326-A1 AZACYANINE DYES AND USE THEREOF INMT, AZI2, MYADM KMT2A 574/4885NPC1 3034/4885L3MBTL1 879/4885
US-20160356681-A1 MODIFIED CARBOCYANINE DYES AND THEIR CONJUGATES IK, CBR3, DRD5 KMT2A 2895/4885NPC1 2746/4885L3MBTL1 3018/4885
US-20190292371-A1 AZACYANINE DYES AND USE THEREOF INMT, AZI2, MYADM KMT2A 574/4885NPC1 3034/4885L3MBTL1 879/4885
US-10633542-B2 Azacyanine dyes and use thereof INMT, AZI2, MYADM KMT2A 574/4885NPC1 3034/4885L3MBTL1 879/4885
US-20180079906-A1 AZACYANINE DYES AND USE THEREOF INMT, AZI2, MYADM KMT2A 574/4885NPC1 3034/4885L3MBTL1 879/4885
US-20060004188-A1 Intermediates and the synthesis of modified carbocyanine dyes and their conjugates CBR3, IK, CYBA KMT2A 3170/4885NPC1 2378/4885L3MBTL1 3229/4885
US-20060099638-A1 Modified carbocyanine dyes and their conjugates IK, CBR3, DRD5 KMT2A 2895/4885NPC1 2746/4885L3MBTL1 3018/4885

“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.