SCHEMBL2854571

SCHEMBL2854571

O=C(O)C=Cc1ccc2cccc(O)c2n1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 14/20 0.63
MEN1 O00255 12/20 0.63
NPC1 O15118 11/20 0.63
RAB9A P51151 10/20 0.63
KDM4E B2RXH2 8/20 0.63
SMN1; SMN2 Q16637 5/20 0.63
POLB P06746 1/20 0.63
LMNA P02545 5/20 0.59
CD74 P04233 1/20 0.59
MIF P14174 1/20 0.59
MAPT P10636 5/20 0.55
HSP90AA1 P07900 4/20 0.55
HTT P42858 4/20 0.55
AGTR1 P30556 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
PIM1 P11309 1/20 0.53
PKM P14618 1/20 0.52
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52
RELA Q04206 1/20 0.52

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
SCHEMBL2856921 1.00 KMT2A (0.63) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL2854566 1.00 KMT2A (0.63) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL3551268 0.85 KMT2A (0.61) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL3551272 0.85 KMT2A (0.61) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL2134734 0.83 LMNA (0.58) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL2134737 0.83 LMNA (0.58) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL10309021 0.80 PFKFB3 (0.74) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL10275161 0.80 PFKFB3 (0.74) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL12066587 0.79 KMT2A (0.62) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL7513553 0.79 KMT2A (0.62) KMT2AMEN1NPC1RAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010094643-A1 QUINOLINE DERIVATIVES AND THEIR USES FOR RHINITIS AND URTICARIA GLAXO GROUP LIMITED (GB) 2010-08-26 WO disclosed
EP-2027108-B1 HISTAMINE RECEPTOR ANTAGONISTS COMPRISING AN AZEPIN CORE GLAXO GROUP LTD (GB) 2010-01-13 EP disclosed
US-20090181950-A1 Histamine Receptor Antagonists Comprising an Azepin Core GLAXO GROUP LIMITED (GB) 2009-07-16 US disclosed
EP-2027108-A1 HISTAMINE RECEPTOR ANTAGONISTS COMPRISING AN AZEPIN CORE Glaxo Group Limited (GB) 2009-02-25 EP disclosed
WO-2007135081-A1 HISTAMINE RECEPTOR ANTAGONISTS COMPRISING AN AZEPIN CORE GLAXO GROUP LIMITED (GB) 2007-11-29 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-20090181950-A1 Histamine Receptor Antagonists Comprising an Azepin Core HRH2, HRH1, HRH4 KMT2A 1661/4885MEN1 1110/4885NPC1 805/4885

“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.