SCHEMBL2815566

SCHEMBL2815566

CNc1nc2ccccc2n2c(CC(C)C)cnc12

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.51
IKBKB O14920 5/20 0.47
CHUK O15111 3/20 0.47
TOP2A P11388 1/20 0.45
TLR7 Q9NYK1 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
HIF1A Q16665 1/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.40
LCK P06239 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
SCHEMBL2814584 0.84 IKBKB (0.52) IKBKBCHUKTLR7KMT2AMEN1
SCHEMBL2814034 0.82 TLR7 (0.44) TLR7SMN1; SMN2LMNAKMT2AMEN1
SCHEMBL2815048 0.82 TLR7 (0.56) TLR7SMN1; SMN2LMNAKMT2AMEN1
SCHEMBL2815787 0.81 HTR2C (0.50) HTR2CIKBKBCHUKTOP2ASMN1; SMN2
SCHEMBL12440249 0.80 HTR2C (0.49) HTR2CIKBKBCHUKTOP2ASMN1; SMN2
SCHEMBL2816324 0.80 TLR7 (0.43) TLR7SMN1; SMN2LMNAHIF1AKMT2A
SCHEMBL2816012 0.80 TLR7 (0.43) IKBKBTLR7SMN1; SMN2LMNAKMT2A
SCHEMBL2819718 0.77 IKBKB (0.69) HTR2CIKBKBCHUKTOP2ASMN1; SMN2
SCHEMBL2816677 0.75 HTR2C (0.51) HTR2CIKBKBCHUKTOP2ASMN1; SMN2
SCHEMBL2820509 0.73 TOP2A (0.52) HTR2CTOP2ATLR7SMN1; 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 3 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 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.