SCHEMBL1000845

SCHEMBL1000845

C(=C\Nc1ccccc1)\C=N\c1ccccc1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.86
KDM4E B2RXH2 2/20 0.54
CYP2D6 P10635 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
ALDH1A1 P00352 6/20 0.40
NPC1 O15118 1/20 0.39
NFKB1 P19838 1/20 0.39
RAB9A P51151 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TDP1 Q9NUW8 3/20 0.36
CYP1A1 P04798 1/20 0.36
TSHR P16473 1/20 0.36
CYP1B1 Q16678 1/20 0.36
MEN1 O00255 4/20 0.35
IDO1 P14902 1/20 0.34

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
SCHEMBL1405654 1.00 KMT2A (0.86) KMT2AKDM4ECYP2D6CYP1A2CYP2C9
SCHEMBL136513 1.00 KMT2A (0.86) KMT2AKDM4ECYP2D6CYP1A2CYP2C9
SCHEMBL724000 1.00 KMT2A (0.86) KMT2AKDM4ECYP2D6CYP1A2CYP2C9
SCHEMBL47043 1.00 KMT2A (0.86) KMT2AKDM4ECYP2D6CYP1A2CYP2C9
Hydrochloric Acid SCHEMBL7862302 0.98 KMT2A (0.83) KMT2AKDM4ECYP2D6CYP1A2CYP2C9
Hydrochloric Acid SCHEMBL224806 0.98 KMT2A (0.83) KMT2AKDM4ECYP2D6CYP1A2CYP2C9
Hydrochloric Acid SCHEMBL10522089 0.98 KMT2A (0.83) KMT2AKDM4ECYP2D6CYP1A2CYP2C9
Hydrochloric Acid SCHEMBL224805 0.98 KMT2A (0.83) KMT2AKDM4ECYP2D6CYP1A2CYP2C9
SCHEMBL47235 0.92 KMT2A (1.00) KMT2AKDM4ECYP2D6CYP1A2CYP2C9
SCHEMBL13223423 0.92 KMT2A (1.00) KMT2AKDM4ECYP2D6CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4283475-A Pentamethine thiopyrylium salts, process for production thereof, and photoconductive compositions containing said salts FUJI PHOTO FILM CO., LTD. (JP) 1981-08-11 US claimed
US-20200263231-A1 Fluorogenic dyes for high sensitivity DNA detection Life Technologies Corporation 2020-08-20 US disclosed
EP-2408863-B1 NUCLEIC ACID BINDING DYES AND USES THEREFOR PROMEGA CORP (US) 2018-01-10 EP disclosed
US-9458499-B2 Nucleic acid binding dyes and uses therefor PROMEGA CORPORATION (US) 2016-10-04 US disclosed
US-9382425-B2 Aza-benzazolium containing cyanine dyes Life Technologies Corporation (US) 2016-07-05 US disclosed
US-20160083782-A1 NUCLEIC ACID BINDING DYES AND USES THEREFOR JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2016-03-24 US disclosed
US-9206474-B2 Nucleic acid binding dyes and uses therefor PROMEGA CORPORATION (US) 2015-12-08 US disclosed
US-20150031579-A1 Aza-Benzazolium Containing Cyanine Dyes MOLECULAR PROBES, INC. 2015-01-29 US disclosed
US-8883415-B2 Aza-benzazolium containing cyanine dyes Life Technologies Corporation (US) 2014-11-11 US disclosed
US-20140178882-A1 NUCLEIC ACID BINDING DYES AND USES THEREFOR PROMEGA CORPORATION (US) 2014-06-26 US disclosed
US-6458967-B1 REACTING ACETYLENE COMPOUNDS TO FORM ENOL ETHER; REACTING WITH SULFUR OR SELENIUM OR TELLURIUM COMPOUND TO FORM DYE PRODUCT THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK 2002-10-01 US disclosed
US-20020022723-A1 Method for preparation of an intermediate dye product RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK, THE STATE UNIVERSITY OF NEW YORK AT BUFFALO 2002-02-21 US disclosed
WO-2002000642-A1 METHOD FOR PREPARATION OF AN INTERMEDIATE DYE PRODUCT THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2002-01-03 WO disclosed
EP-0675924-B1 CYCLIC-SUBSTITUTED UNSYMMETRICAL CYANINE DYES MOLECULAR PROBES INC (US) 2001-12-12 EP disclosed
US-5658751-A SUBSTITUENTS ON PYRIDINIUM OR QUINOLINIUM RING SYSTEM SERVE TO INCREASE OR DECREASE PERMEABILITY, SELECTIVITY AND BINDING AFFINITY OF NUCLEIC ACID STAINS; FORM FLUORESCENT COMPLEXES WITH NUCLEIC ACIDS MOLECULAR PROBES, INC. (US) 1997-08-19 US disclosed
US-5545535-A USING MIXTURE OF FLUORESCENT DYES MOLECULAR PROBES, INC. (US) 1996-08-13 US disclosed
US-5436134-A Fluorescent dyes for nucleic acids MOLECULAR PROBES, INC. (US) 1995-07-25 US disclosed
US-4663260-A SEMICONDUCTOR LASER WAVELENGTHS FUJI PHOTO FILM CO., LTD. (JP) 1987-05-05 US disclosed
US-4283475-A Pentamethine thiopyrylium salts, process for production thereof, and photoconductive compositions containing said salts FUJI PHOTO FILM CO., LTD. (JP) 1981-08-11 US disclosed
US-4239901-A ANALGESICS, ANTIPYRETICS, ANTIINFLAMMATORY AGENTS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1980-12-16 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-20020022723-A1 Method for preparation of an intermediate dye product SRD5A1, SRD5A2, RER1 KMT2A 2804/4885KDM4E 3201/4885CYP2D6 623/4885
US-20200263231-A1 Fluorogenic dyes for high sensitivity DNA detection POLRMT, POLM, DNMT3A KMT2A 1550/4885KDM4E 3509/4885CYP2D6 1836/4885

“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.