SCHEMBL2815092

SCHEMBL2815092

CNc1nc2ccccc2n2c(-c3ccc(C(=O)O)cc3)cnc12

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 6/20 0.46
CHUK O15111 3/20 0.46
HTR2C P28335 1/20 0.44
TNKS O95271 1/20 0.43
PIN1 Q13526 1/20 0.41
TP53 P04637 1/20 0.41
TTK P33981 1/20 0.41
TOP2A P11388 1/20 0.41
SRC P12931 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
PPARG P37231 1/20 0.40
MAPT P10636 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 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
SCHEMBL2815477 0.88 IKBKB (0.58) IKBKBCHUKHTR2CTP53SMN1; SMN2
SCHEMBL2816677 0.88 HTR2C (0.51) IKBKBCHUKHTR2CTP53TOP2A
SCHEMBL2815052 0.86 HTR2C (0.47) IKBKBCHUKHTR2CTP53TOP2A
SCHEMBL123805 0.85 TTK (0.57) TTK
SCHEMBL2815157 0.84 IKBKB (0.47) IKBKBCHUKTNKSTTK
SCHEMBL2818724 0.83 IKBKB (0.48) IKBKBCHUKHTR2CTP53TOP2A
SCHEMBL2818464 0.83 HTR2C (0.47) IKBKBCHUKHTR2CTNKSTP53
SCHEMBL2816389 0.83 HTR2C (0.47) IKBKBCHUKHTR2CTNKSTOP2A
SCHEMBL2817187 0.82 ADORA2A (0.43) PIN1SMN1; SMN2PPARG
SCHEMBL2817059 0.81 MAPT (0.47) IKBKBCHUKHTR2CTP53TOP2A

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
EP-2205602-B1 IMIDAZO[1,2-A]QUINOXALINES AND DERIVATIVES THEREOF FOR TREATING CANCERS UNIV MONTPELLIER (FR) 2018-09-26 EP 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
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 IKBKB 855/4885CHUK 409/4885HTR2C 1292/4885

“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.