SCHEMBL3296576

SCHEMBL3296576

C1CCC(Nc2nc(NC3CCCCC3)nc(NC3CCCCC3)n2)CC1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.64
KDM4E B2RXH2 1/20 0.60
GAA P10253 1/20 0.60
NPSR1 Q6W5P4 2/20 0.50
RAB9A P51151 1/20 0.50
HDAC3 O15379 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
CTSK P43235 2/20 0.47
CTSS P25774 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NPY5R Q15761 1/20 0.46
PAK1 Q13153 1/20 0.46

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
SCHEMBL20402877 0.89 PDE4A (0.82) PDE4AKDM4EGAANPSR1RAB9A
SCHEMBL20402878 0.89 PDE4A (0.82) PDE4AKDM4EGAANPSR1RAB9A
SCHEMBL8053847 0.89 PDE4A (0.59) PDE4AKDM4EGAANPSR1RAB9A
SCHEMBL18557113 0.89 PDE4A (0.82) PDE4AKDM4EGAANPSR1RAB9A
SCHEMBL6640516 0.89 PDE4A (0.55) PDE4AKDM4EGAANPSR1RAB9A
SCHEMBL11794474 0.89 PDE4A (0.82) PDE4AKDM4EGAANPSR1RAB9A
SCHEMBL18557112 0.89 PDE4A (0.82) PDE4AKDM4EGAANPSR1RAB9A
SCHEMBL18760598 0.89 PDE4A (0.82) PDE4AKDM4EGAANPSR1RAB9A
SCHEMBL17070790 0.89 PDE4A (0.55) PDE4AKDM4EGAANPSR1RAB9A
SCHEMBL20402844 0.87 PDE4A (0.53) PDE4AKDM4EGAANPSR1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7741390-B2 Coordination-polymeric triethanolamineperchlorato(triflato)metal inner complexes as additives for synthetic polymers ARTEMIS RESEARCH GMBH & CO. KG (DE) 2010-06-22 US disclosed
US-20090131564-A1 COORDINATION-POLYMERIC TRIETHANOLAMINEPERCHLORATO(TRIFLATO)METAL INNER COMPLEXES AS ADDITIVES FOR SYNTHETIC POLYMERS IKA INNOVATIVE KUNSTSTOFFAUFBEREITUNG GMBH & CO. KG (DE) 2009-05-21 US disclosed
US-20090105387-A1 Coordination-polymeric triethanolamineperchlorato(triflato)metal inner complexes as additives for synthetic polymers ARTEMIS RESEARCH GMBH & CO. KG (DE) 2009-04-23 US disclosed
EP-1057821-B1 METHOD FOR MODIFYING MELAMINE DERIVATIVES NISSAN CHEMICAL IND LTD (JP) 2004-05-26 EP disclosed
EP-1044198-B1 MORPHOLINO END-CAPPED, HINDERED AMINE SUBSTITUTED AMINOTRIAZINE AND THEIR USE AS LIGHT STABILIZERS CYTEC TECH CORP (US) 2004-01-21 EP disclosed
US-6307046-B1 HEATING MELAMINE AND AN ALCOHOL IN THE PRESENCE OF A MIXED CATALYST COMPRISING A HYDROGENATION CATALYST AND A DEHYDROGENATION CATALYST AND HYDROGEN NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2001-10-23 US disclosed
EP-0882720-B1 METHODS FOR MODIFYING 1,3,5-TRIAZINE DERIVATIVES NISSAN CHEMICAL IND LTD (JP) 2001-08-22 EP disclosed
EP-1057821-A1 METHOD FOR MODIFYING MELAMINE DERIVATIVES Nissan Chemical Industries, Ltd. (JP) 2000-12-06 EP disclosed
EP-1044198-A1 MORPHOLINO END-CAPPED, HINDERED AMINE SUBSTITUTED AMINOTRIAZINE AND THEIR USE AS LIGHT STABILIZERS CYTEC TECHNOLOGY CORP. (US) 2000-10-18 EP disclosed
US-6130332-A USING A GROUP 8 METAL CATALYST AND ALDEHYDES OR KETONE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2000-10-10 US disclosed
EP-0882720-A1 METHODS FOR MODIFYING 1,3,5-TRIAZINE DERIVATIVES NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1998-12-09 EP disclosed
EP-0834523-A1 EPOXY/ACID ANHYDRIDE COMPOSITION NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1998-04-08 EP disclosed
EP-0760369-A1 PROCESS FOR ALKYLATING TRIAZINE DERIVATIVE NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1997-03-05 EP disclosed
EP-0145660-B1 INSECTICIDAL COMPOSITION CIBA-GEIGY AG (CH) 1990-04-18 EP disclosed
US-4824845-A CONTROLLING ECTOPARASITES IN ANIMALS CIBA-GEIGY CORPORATION (US) 1989-04-25 US disclosed
EP-0145660-A2 Insecticidal composition CIBA-GEIGY AG (CH) 1985-06-19 EP disclosed
US-4225598-A 2-Cyclopropylamino-4,6-diamino-s-triazine CIBA-GEIGY CORPORATION (US) 1980-09-30 US disclosed
US-4160831-A LARVICIDES CIBA-GEIGY CORPORATION (US) 1979-07-10 US disclosed
US-4160832-A LARVICIDES CIBA-GEIGY CORPORATION (US) 1979-07-10 US disclosed
US-4136075-A ACRYLIC ACID AND ESTER COPOLYMER, THERMOSETTING, CROSSLINKING AGENT, COATINGS FOR METALS A. E. STALEY MANUFACTURING COMPANY (US) 1979-01-23 US disclosed