SCHEMBL481996

SCHEMBL481996

Clc1ccc(C2=NC=C[N]2)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.39
LMNA P02545 2/20 0.38
CYP2A6 P11509 1/20 0.38
ALOX5 P09917 1/20 0.37
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
AHR P35869 1/20 0.34
NOTUM Q6P988 3/20 0.34
POLB P06746 1/20 0.34
PTPN11 Q06124 1/20 0.34
KDM4E B2RXH2 2/20 0.33
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
RPA1 P27694 1/20 0.33
METAP2 P50579 1/20 0.33
GCGR P47871 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
RECQL P46063 1/20 0.32

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
SCHEMBL5111459 0.76 TDP1 (0.38) CYP1A2LMNANPC1RAB9ANOTUM
SCHEMBL7175606 0.69 APP (0.46) CYP1A2LMNANOTUMPOLBKDM4E
SCHEMBL28215 0.66 CYP1A2 (0.73) CYP1A2LMNACYP2A6ALOX5NPC1
SCHEMBL11165087 0.66 CYP1A2 (0.73) CYP1A2LMNACYP2A6ALOX5NPC1
SCHEMBL3952742 0.66 CYP1A2 (0.73) CYP1A2LMNACYP2A6ALOX5NPC1
SCHEMBL9465032 0.64 CYP2A6 (0.42) CYP2A6
SCHEMBL9465289 0.64 ERN1 (0.33) CYP1A2
SCHEMBL25437316 0.63 CYP1A2 (0.69) CYP1A2LMNACYP2A6ALOX5NPC1
Hydrogen Sulfide SCHEMBL10394839 0.63 CYP1A2 (0.69) CYP1A2LMNACYP2A6ALOX5NPC1
SCHEMBL4861976 0.62 CYP2A6 (0.56) CYP1A2LMNACYP2A6KDM4EMETAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1937669-B9 NOVEL BENZOPYRAN DERIVATIVES AS POTASSIUM CHANNEL OPENERS JANSSEN PHARMACEUTICA NV (BE) 2012-07-18 EP claimed
EP-1937669-B1 NOVEL BENZOPYRAN DERIVATIVES AS POTASSIUM CHANNEL OPENERS JANSSEN PHARMACEUTICA NV (BE) 2012-02-01 EP claimed
US-7812183-B2 Benzopyran derivatives as potassium channel openers JANSSEN PHARMACEUTICA NV (BE) 2010-10-12 US claimed
CN-101296925-A Novel benzopyran derivatives as potassium channel openers JANSSEN PHARMACEUTICA NV (BE) 2008-10-29 CN claimed
EP-1680420-A4 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS INC (US) 2008-09-24 EP claimed
EP-1940516-A2 BENZOPYRAN AND PYRANOPYRIDINE DERIVATIVES AS POTASSIUM CHANNEL OPENERS Janssen Pharmaceutica, N.V. (BE) 2008-07-09 EP claimed
EP-1937669-A1 NOVEL BENZOPYRAN DERIVATIVES AS POTASSIUM CHANNEL OPENERS JANSSEN PHARMACEUTICA N.V. (BE) 2008-07-02 EP claimed
JP-2007510660-A 2007-04-26 JP claimed
US-20070072832-A1 NOVEL BENZOPYRAN DERIVATIVES AS POTASSIUM CHANNEL OPENERS JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-29 US claimed
WO-2007027959-A1 NOVEL BENZOPYRAN DERIVATIVES AS POTASSIUM CHANNEL OPENERS JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-08 WO claimed
WO-2007027780-A2 BENZOPYRAN AND PYRANOPYRIDINE DERIVATIVES AS POTASSIUM CHANNEL OPENERS JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-08 WO claimed
US-20070049556-A1 NOVEL BENZOPYRAN DERIVATIVES AS POTASSIUM CHANNEL OPENERS JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-01 US claimed
EP-1513820-A4 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS INC (US) 2006-09-13 EP claimed
EP-1680420-A2 COMPOUNDS, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2006-07-19 EP claimed
US-20060111374-A1 Compounds, compositions, and methods CYTOKINETICS, INC. 2006-05-25 US claimed
US-20050148593-A1 Treating cell proliferation disorder, anticancer agents CYTOKINETICS, INC. 2005-07-07 US claimed
WO-2005046588-A2 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2005-05-26 WO claimed
EP-1513820-A2 COMPOUNDS, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2005-03-16 EP claimed
US-20040116438-A1 Compounds, compositions, and methods CYTOKINETICS, INCORPORATED 2004-06-17 US claimed
WO-2003103575-A2 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2003-12-18 WO 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-20050148593-A1 Treating cell proliferation disorder, anticancer agents MKI67, PCNA, CCNH CYP1A2 4503/4885LMNA 1997/4885CYP2A6 4202/4885
US-20060111374-A1 Compounds, compositions, and methods ALPP, MKI67, PCNA CYP1A2 4057/4885LMNA 543/4885CYP2A6 3218/4885
US-20070049556-A1 NOVEL BENZOPYRAN DERIVATIVES AS POTASSIUM CHANNEL OPENERS KCNJ2, KCNN1, KCNN3 CYP1A2 874/4885LMNA 1200/4885CYP2A6 1099/4885
US-20070072832-A1 NOVEL BENZOPYRAN DERIVATIVES AS POTASSIUM CHANNEL OPENERS KCNJ2, KCNN1, KCNN3 CYP1A2 874/4885LMNA 1200/4885CYP2A6 1099/4885

“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.