SCHEMBL14892273

SCHEMBL14892273

OC1CCCN(c2ccc3[nH]c(-c4ccc5[nH]c(-c6ccccn6)nc5c4)nc3c2)C1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CBFB Q13951 6/20 0.49
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 2/20 0.46
PKM P14618 2/20 0.46
KDM4E B2RXH2 2/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 2/20 0.46
GCK P35557 7/20 0.44
METAP2 P50579 2/20 0.43
METAP1 P53582 2/20 0.43
HPGD P15428 2/20 0.43
MTOR P42345 1/20 0.43
KCNMA1 Q12791 1/20 0.41
ALDH1A1 P00352 1/20 0.40
PDE10A Q9Y233 1/20 0.40

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
SCHEMBL14906740 0.91 CBFB (0.59) CBFBNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL14892344 0.88 CBFB (0.55) CBFBNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL20350768 0.86 CBFB (0.59) CBFBNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL14892719 0.83 CBFB (0.56) CBFBNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL125111 0.81 CBFB (0.67) CBFBNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL14892725 0.81 ALDH1A1 (0.39) NPC1RAB9ASMN1; SMN2PKMKDM4E
SCHEMBL14892359 0.81 CBFB (0.53) CBFBNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL14892238 0.81 CBFB (0.53) CBFBNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL125289 0.80 CBFB (0.65) CBFBNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL14892245 0.80 CBFB (0.57) CBFBNPC1RAB9ASMN1; SMN2LMNA

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-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

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 230/4885RAB9A 2599/4885

“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.