SCHEMBL6946151

SCHEMBL6946151

Nc1nc(N2C(=O)CCC2=O)nc(N2C(=O)CCC2=O)n1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.34
KMT2A Q03164 1/20 0.33
DPP4 P27487 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL1033693 0.95 RECQL (0.34) RECQLKMT2ADPP4CA12CA1
SCHEMBL8157034 0.91 KMT2A (0.35) KMT2ADPP4ALDH1A1
SCHEMBL6951089 0.87 RECQL (0.40) RECQLKMT2ADPP4CA12CA1
SCHEMBL8162676 0.77 KMT2A (0.41) RECQLKMT2ADPP4KDM4EALDH1A1
SCHEMBL8157954 0.77 RECQL (0.33) RECQLKMT2ACA12CA1CA2
SCHEMBL8162746 0.76 RECQL (0.34) RECQLKMT2AKDM4EALDH1A1HPGD
SCHEMBL8156172 0.69 ALPL (0.41) KMT2AALDH1A1HPGDHRH4TSHR
SCHEMBL15952641 0.64 LMNA (0.44) RECQLKMT2AKDM4EALDH1A1HPGD
SCHEMBL11790569 0.64 HSP90AB1 (0.30)
SCHEMBL11573348 0.64 CYP1A2 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6013797-A CURING AGENT WHICH CROSSLINKS RESINS BY DECYCLIZATION WITHOUT RELEASING VOLATILE ORGANIC COMPOUNDS; FORMALDEHYDE-FREE CYTEC TECHNOLOGY CORP. (US) 2000-01-11 US claimed
EP-0885214-A1 CYCLIC IMIDO-1,3,5-TRIAZINE CROSSLINKING AGENTS Cytec Technology Corp. (US) 1998-12-23 EP claimed
WO-1997031914-A1 CYCLIC IMIDO-1,3,5-TRIAZINE CROSSLINKING AGENTS CYTEC TECHNOLOGY CORP. (US) 1997-09-04 WO claimed
EP-1279673-A1 Imidotriazine derivatives Agrolinz Melamin GmbH (AT) 2003-01-29 EP disclosed