SCHEMBL2816677

SCHEMBL2816677

CNc1nc2ccccc2n2c(-c3ccccc3)cnc12

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.51
IKBKB O14920 8/20 0.50
CHUK O15111 5/20 0.50
TOP2A P11388 1/20 0.48
KDM4E B2RXH2 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
POLB P06746 2/20 0.42
HSD17B10 Q99714 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LCK P06239 1/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.41
ADORA2A P29274 1/20 0.40
LMNA P02545 2/20 0.39
HIF1A Q16665 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL2818464 0.90 HTR2C (0.47) HTR2CIKBKBCHUKTOP2AKDM4E
SCHEMBL2816389 0.90 HTR2C (0.47) HTR2CIKBKBCHUKTOP2AKDM4E
SCHEMBL2815052 0.90 HTR2C (0.47) HTR2CIKBKBCHUKTOP2AKDM4E
SCHEMBL2818724 0.90 IKBKB (0.48) HTR2CIKBKBCHUKTOP2AKDM4E
SCHEMBL2815092 0.88 IKBKB (0.46) HTR2CIKBKBCHUKTOP2AKDM4E
SCHEMBL2817059 0.87 MAPT (0.47) HTR2CIKBKBCHUKTOP2AKDM4E
SCHEMBL17895220 0.87 IKBKB (0.49) HTR2CIKBKBCHUKTOP2AKDM4E
SCHEMBL2815160 0.86 IKBKB (0.47) HTR2CIKBKBCHUKTOP2AKDM4E
SCHEMBL2818524 0.86 HTR2C (0.44) HTR2CIKBKBCHUKTOP2AKDM4E
SCHEMBL2816218 0.86 IKBKB (0.47) HTR2CIKBKBCHUKTOP2AKDM4E

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 HTR2C 1292/4885IKBKB 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.