SCHEMBL2815859

SCHEMBL2815859

OC(CCc1ccccc1)CNc1nc2ccccc2nc1Cl

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ APP P05067 2/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.40
▸ TSHR P16473 1/20 0.38
▸ DHFR P00374 1/20 0.38
▸ PLAU P00749 2/20 0.37
▸ BCHE P06276 2/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ PDE5A O76074 1/20 0.37
▸ MAPK1 P28482 1/20 0.36
▸ SLC6A2 P23975 2/20 0.36
▸ SLC6A4 P31645 2/20 0.36
▸ SLC6A3 Q01959 2/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36

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
SCHEMBL2815998 1.00 KDM4E (0.46) KDM4ENPSR1L3MBTL1APPRXFP1
SCHEMBL2814275 0.78 KDM4E (0.51) KDM4ENPSR1L3MBTL1RXFP1BCHE
SCHEMBL2815178 0.78 KDM4E (0.51) KDM4ENPSR1L3MBTL1RXFP1BCHE
SCHEMBL13883984 0.77 KDM4E (0.53) KDM4ENPSR1L3MBTL1APPRXFP1
SCHEMBL2820452 0.73 KDM4E (0.46) KDM4ENPSR1L3MBTL1APPRXFP1
SCHEMBL3646261 0.72 KDM4E (0.51) KDM4ENPSR1L3MBTL1RXFP1TDP1
SCHEMBL8111822 0.70 KDM4E (0.55) KDM4ENPSR1L3MBTL1RXFP1TDP1
SCHEMBL27210140 0.69 SLC6A2 (0.47) TSHRTDP1SLC6A2SLC6A4SLC6A3
SCHEMBL8371056 0.69 MMP12 (0.49) TSHRTDP1SLC6A2SLC6A4SLC6A3
SCHEMBL3769347 0.69 MMP12 (0.49) TSHRTDP1SLC6A2SLC6A4SLC6A3

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 5 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
EP-2205602-A1 IMIDAZOÝL,2- ¨QUINOXALINES AND DERIVATIVES THEREOF FOR TREATING CANCERS Université de Montpellier I (FR) 2010-07-14 — — EP disclosed
WO-2009043934-A1 IMIDAZO[L,2-α]QUINOXALINES AND DERIVATIVES THEREOF FOR TREATING CANCERS UNIVERSITE DE MONTPELLIER I (FR) 2009-04-09 — — WO 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 KDM4E 2878/4885NPSR1 4376/4885L3MBTL1 3674/4885

“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.

Send feedback