SCHEMBL2565858

SCHEMBL2565858

c1ccc(-c2nc3cc(-c4nc5cc(N6CCOCC6)ccc5[nH]4)ccc3[nH]2)nc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CBFB Q13951 9/20 0.76
NPC1 O15118 2/20 0.51
LMNA P02545 2/20 0.51
PKM P14618 2/20 0.51
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
KDM4E B2RXH2 1/20 0.51
MAPT P10636 1/20 0.51
KMT2A Q03164 1/20 0.51
METAP1 P53582 6/20 0.48
METAP2 P50579 5/20 0.48
MTOR P42345 2/20 0.48
HPGD P15428 1/20 0.48
FGFR1 P11362 2/20 0.47
FLT1 P17948 2/20 0.47
TERT O14746 1/20 0.46
CHEK2 O96017 1/20 0.44
ACHE P22303 1/20 0.43
PDGFRB P09619 1/20 0.43
KDR P35968 1/20 0.43

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
SCHEMBL124347 0.94 CBFB (0.84) CBFBNPC1LMNAPKMRAB9A
SCHEMBL14906579 0.90 CBFB (0.89) CBFBNPC1LMNAPKMRAB9A
SCHEMBL20350768 0.89 CBFB (0.59) CBFBNPC1LMNAPKMRAB9A
SCHEMBL14891706 0.87 CBFB (0.57) CBFBNPC1LMNAPKMRAB9A
SCHEMBL14892245 0.87 CBFB (0.57) CBFBNPC1LMNAPKMRAB9A
SCHEMBL14892719 0.86 CBFB (0.56) CBFBNPC1LMNAPKMRAB9A
SCHEMBL14892351 0.86 CBFB (0.56) CBFBSMN1; SMN2MAPTKMT2AHPGD
SCHEMBL14892344 0.85 CBFB (0.55) CBFBNPC1LMNAPKMRAB9A
SCHEMBL2558498 0.85 CBFB (0.55) CBFBNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL14892162 0.85 CBFB (0.54) CBFBNPC1LMNAPKMRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE46943-E1 Radioprotector compounds and methods PETER MACCALLUM CANCER INSTITUTE (AU) 2018-07-10 US claimed
EP-2556058-B1 RADIOPROTECTOR COMPOUNDS AND METHODS PETER MACCALLUM CANCER INST (AU) 2017-06-14 EP claimed
US-8999993-B2 Radioprotector compounds and methods PETER MACCALLUM CANCER INSTITUTE (AU) 2015-04-07 US claimed
US-20130109678-A1 RADIOPROTECTOR COMPOUNDS AND METHODS PETER MACCALLUM CANCER INSTITUTE (AU) 2013-05-02 US claimed
US-RE46943-E1 Radioprotector compounds and methods PETER MACCALLUM CANCER INSTITUTE (AU) 2018-07-10 US disclosed
EP-2556058-B1 RADIOPROTECTOR COMPOUNDS AND METHODS PETER MACCALLUM CANCER INST (AU) 2017-06-14 EP disclosed
US-8999993-B2 Radioprotector compounds and methods PETER MACCALLUM CANCER INSTITUTE (AU) 2015-04-07 US disclosed
US-20130109678-A1 RADIOPROTECTOR COMPOUNDS AND METHODS PETER MACCALLUM CANCER INSTITUTE (AU) 2013-05-02 US disclosed
EP-2556058-A1 RADIOPROTECTOR COMPOUNDS AND METHODS Peter MacCallum Cancer Institute (AU) 2013-02-13 EP disclosed
WO-2011123890-A1 RADIOPROTECTOR COMPOUNDS AND METHODS PETER MACCALLUM CANCER INSTITUTE (AU) 2011-10-13 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-20130109678-A1 RADIOPROTECTOR COMPOUNDS AND METHODS NR1H2, NR1H3, NR1I3 CBFB 688/4885NPC1 230/4885LMNA 584/4885

“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.