SCHEMBL3045310

SCHEMBL3045310

CCCCN(CCCC)c1ccc(C=Cc2ccc(N(CCCC)CCCC)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.60
CHRM4 P08173 2/20 0.60
CHRM5 P08912 2/20 0.60
CHRM1 P11229 2/20 0.60
CHRM3 P20309 2/20 0.60
INSR P06213 2/20 0.52
ATG4B Q9Y4P1 1/20 0.48
KDM4A O75164 2/20 0.47
KDM2A Q9Y2K7 2/20 0.47
AR P10275 1/20 0.46
ALDH1A1 P00352 2/20 0.45
ALDH3A1 P30838 1/20 0.45
ALDH1A3 P47895 1/20 0.45
MAPT P10636 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
THRB P10828 1/20 0.44
MAPK1 P28482 1/20 0.44

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
SCHEMBL3045309 1.00 CHRM2 (0.60) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9915629 1.00 CHRM2 (0.60) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL6810830 1.00 CHRM2 (0.60) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL2604957 0.96 CHRM2 (0.57) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9915589 0.94 CHRM2 (0.56) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL1832514 0.94 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL5712574 0.94 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL5712573 0.94 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL18159314 0.93 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL18159320 0.93 CHRM2 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1153097-A1 A PRESSURE-SENSITIVE ADHESIVE LAMINATE, A METHOD AND A DEVICE FOR MODIFYING AN INITIAL RELEASE FORCE IN SUCH A LAMINATE Francois, Jean-Marc (BE) 2001-11-14 EP claimed
WO-2000031199-A9 A PRESSURE-SENSITIVE ADHESIVE LAMINATE, A METHOD AND A DEVICE FOR MODIFYING AN INITIAL RELEASE FORCE IN SUCH A LAMINATE FRANCOIS JEAN MARC (BE) 2001-04-05 WO claimed
WO-2000031199-A1 A PRESSURE-SENSITIVE ADHESIVE LAMINATE, A METHOD AND A DEVICE FOR MODIFYING AN INITIAL RELEASE FORCE IN SUCH A LAMINATE FRANCOIS JEAN MARC (BE) 2000-06-02 WO claimed
US-8197722-B2 Irradiating the compound (containing two electron donor groups and a bridge of pi-conjugated bonds containing electron donor groups) with light, and the compound is converted to a multi-photon electronically excited state THE CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2012-06-12 US disclosed
US-20100207078-A1 DEPROTECTION OF FUNCTIONAL GROUPS BY MULTI-PHOTON INDUCED ELECTRON TRANSFER THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2010-08-19 US disclosed
WO-2008008481-A2 DEPROTECTION OF FUNCTIONAL GROUPS BY MULTI-PHOTON INDUCED ELECTRON TRANSFER GEORGIA TECH RESEARCH CORPORATION (US) 2008-01-17 WO disclosed
US-6566529-B1 Dithienylthiophene derivatives attached to a 1,3,4-oxadiazole group and to either a carbazole group or a triphenylamine group, both attachments through vinylene groups; particularly for protection of human eyes and sensitive photodetectors THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY 2003-05-20 US disclosed
US-20020185634-A1 Two-photon or higher-order absorbing optical materials and methods of use CALIFORNIA INSTITUTE OF TECHNOLOGY 2002-12-12 US disclosed
US-6322931-B1 PHOTOPOLYMER INCLUDING: PHOTO-ACID GENERATOR; AN ACTIVE BINDER; CATIONIC RING OPENING MONOMER WHICH UNDERGOES POLYMERIZATION WHEN EXPOSED TO SAID ACID; AND NONLINEAR ABSORBING MOLECULES DISSOLVED THROUGHOUT SAID PHOTOPOLYMER SIROS TECHNOLOGIES, INC. 2001-11-27 US disclosed
EP-1153097-A1 A PRESSURE-SENSITIVE ADHESIVE LAMINATE, A METHOD AND A DEVICE FOR MODIFYING AN INITIAL RELEASE FORCE IN SUCH A LAMINATE Francois, Jean-Marc (BE) 2001-11-14 EP disclosed
US-6267913-B1 IN HOLOGRAPHYL, BIOLOGY, OPTICAL DATA STORAGE CALIFORNIA INSTITUTE OF TECHNOLOGY 2001-07-31 US disclosed
WO-2000031199-A9 A PRESSURE-SENSITIVE ADHESIVE LAMINATE, A METHOD AND A DEVICE FOR MODIFYING AN INITIAL RELEASE FORCE IN SUCH A LAMINATE FRANCOIS JEAN MARC (BE) 2001-04-05 WO disclosed
WO-2000031199-A1 A PRESSURE-SENSITIVE ADHESIVE LAMINATE, A METHOD AND A DEVICE FOR MODIFYING AN INITIAL RELEASE FORCE IN SUCH A LAMINATE FRANCOIS JEAN MARC (BE) 2000-06-02 WO disclosed
WO-1998021521-A9 TWO-PHOTON OR HIGHER-ORDER ABSORBING OPTICAL MATERIALS AND METHODS OF USE CALIFORNIA INST OF TECHN (US) 2000-03-02 WO disclosed
WO-1998021521-A1 TWO-PHOTON OR HIGHER-ORDER ABSORBING OPTICAL MATERIALS AND METHODS OF USE CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 1998-05-22 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 (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-20100207078-A1 DEPROTECTION OF FUNCTIONAL GROUPS BY MULTI-PHOTON INDUCED ELECTRON TRANSFER GPX4, ERCC4, CYBA CHRM2 4565/4885CHRM4 3952/4885CHRM5 4035/4885

“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.