SCHEMBL2814973

SCHEMBL2814973

CNc1nc2ccccc2n2c(-c3ccc(OC)cc3OC)cnc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.48
IKBKB O14920 3/20 0.46
CHUK O15111 1/20 0.46
MAPT P10636 3/20 0.43
KDM4E B2RXH2 3/20 0.43
NPC1 O15118 1/20 0.42
PKM P14618 1/20 0.42
RAB9A P51151 1/20 0.42
HTR2C P28335 1/20 0.41
PDE2A O00408 1/20 0.41
PDE10A Q9Y233 1/20 0.41
PAX8 Q06710 1/20 0.39
TOP2A P11388 1/20 0.39
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LCK P06239 1/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
ADORA3 P0DMS8 1/20 0.38

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
SCHEMBL2813904 0.88 PDE2A (0.49) TP53IKBKBCHUKKDM4ENPC1
SCHEMBL2813901 0.86 IKBKB (0.51) TP53IKBKBCHUKMAPTKDM4E
SCHEMBL2814037 0.86 TP53 (0.43) TP53IKBKBMAPTKDM4ENPC1
SCHEMBL2817495 0.85 ADORA2A (0.47) TP53MAPTKDM4ENPC1PKM
SCHEMBL2817238 0.85 PDE2A (0.47) TP53MAPTKDM4ENPC1PKM
SCHEMBL2817059 0.83 MAPT (0.47) TP53IKBKBCHUKMAPTKDM4E
SCHEMBL2817762 0.83 IKBKB (0.47) TP53IKBKBCHUKMAPTKDM4E
SCHEMBL30136943 0.83 IKBKB (0.47) TP53IKBKBCHUKMAPTKDM4E
SCHEMBL17895103 0.82 IKBKB (0.49) TP53IKBKBCHUKMAPTKDM4E
SCHEMBL2816766 0.82 PDE2A (0.43) TP53IKBKBCHUKMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2205602-B1 IMIDAZO[1,2-A]QUINOXALINES AND DERIVATIVES THEREOF FOR TREATING CANCERS UNIV MONTPELLIER (FR) 2018-09-26 EP claimed
US-8378098-B2 Imidazol[1,2-α]quinoxalines and derivatives for the treatment of cancers UNIVERSITE DE MONTPELLIER I (FR) 2013-02-19 US claimed
US-20100249142-A1 IMIDAZOL[1,2-alpha]QUINOXALINES AND DERIVATIVES FOR THE TREATMENT OF CANCERS UNIVERSITE DE MONTPELLIER I 2010-09-30 US claimed
EP-2205602-B1 IMIDAZO[1,2-A]QUINOXALINES AND DERIVATIVES THEREOF FOR TREATING CANCERS UNIV MONTPELLIER (FR) 2018-09-26 EP disclosed
US-8378098-B2 Imidazol[1,2-α]quinoxalines and derivatives for the treatment of cancers UNIVERSITE DE MONTPELLIER I (FR) 2013-02-19 US disclosed
US-20100249142-A1 IMIDAZOL[1,2-alpha]QUINOXALINES AND DERIVATIVES FOR THE TREATMENT OF CANCERS UNIVERSITE DE MONTPELLIER I 2010-09-30 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-20100249142-A1 IMIDAZOL[1,2-alpha]QUINOXALINES AND DERIVATIVES FOR THE TREATMENT OF CANCERS IDH3A, NRAS, KRAS TP53 14/4885IKBKB 855/4885CHUK 409/4885

“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.