SCHEMBL2817490

SCHEMBL2817490

COc1nc2ccccc2n2c(CCc3ccccc3)cnc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
PKM P14618 1/20 0.44
KMT2A Q03164 1/20 0.44
ADORA3 P0DMS8 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
IKBKB O14920 1/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 1/20 0.41
ALDH1A1 P00352 6/20 0.40
CYP1A2 P05177 6/20 0.40
CYP2C19 P33261 6/20 0.40
TSHR P16473 5/20 0.40
CYP2C9 P11712 5/20 0.40
CYP3A4 P08684 4/20 0.40
PDE2A O00408 1/20 0.40
USP2 O75604 3/20 0.40
CYP2D6 P10635 2/20 0.40
CLK4 Q9HAZ1 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
HTT P42858 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
SCHEMBL2816012 0.81 TLR7 (0.43) MEN1PKMKMT2AADORA3IKBKB
SCHEMBL2818033 0.81 TYMS (0.47) MEN1PKMKMT2AADORA3LMNA
SCHEMBL2816226 0.81 TLR7 (0.48) MEN1PKMKMT2AADORA3LMNA
SCHEMBL31047843 0.81 TLR7 (0.48) MEN1PKMKMT2AADORA3LMNA
SCHEMBL2815787 0.80 HTR2C (0.50) MEN1PKMKMT2AADORA3IKBKB
SCHEMBL2815865 0.80 MEN1 (0.41) MEN1PKMKMT2ALMNAMAPT
SCHEMBL2817725 0.77 LMNA (0.48) MEN1KMT2AADORA3LMNAMAPT
SCHEMBL2816804 0.77 MAPK8 (0.60) MEN1KMT2AADORA3L3MBTL1LMNA
SCHEMBL2817449 0.76 IKBKB (0.50) MEN1KMT2AADORA3L3MBTL1IKBKB
SCHEMBL2820359 0.74 ADORA3 (0.52) MEN1KMT2AADORA3IKBKBSMN1; SMN2

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 MEN1 187/4885PKM 1180/4885KMT2A 998/4885

“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.