SCHEMBL1879161

SCHEMBL1879161

Cc1cccc2cc(C=O)c(-c3cccs3)nc12

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.44
GAA P10253 2/20 0.44
MGAM O43451 1/20 0.44
SI P14410 1/20 0.44
MGAM2 Q2M2H8 1/20 0.44
ATM Q13315 1/20 0.42
RPS6KB2 Q9UBS0 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 1/20 0.41
ERN1 O75460 3/20 0.40
LMNA P02545 1/20 0.38
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL1880359 0.77 KDR (0.48) KDRGAAATMMAPTERN1
SCHEMBL1881435 0.77 ATM (0.49) KDRGAAATMKDM4EMAPT
SCHEMBL4181249 0.77 ATM (0.56) KDRATMMAPTALDH1A1
SCHEMBL17049363 0.77 RPS6KB2 (0.57) GAAATMRPS6KB2KDM4EMAPT
SCHEMBL29636225 0.77 RPS6KB2 (0.57) GAAATMRPS6KB2KDM4EMAPT
SCHEMBL1881727 0.76 GAA (0.44) GAAMGAMSIMGAM2ATM
SCHEMBL1884716 0.76 GAA (0.44) GAAMGAMSIMGAM2ATM
SCHEMBL4180752 0.74 PIK3CD (0.53) KDRGAAMGAMSIMGAM2
SCHEMBL4182705 0.73 ATM (0.55) KDRGAAATMKDM4EMAPT
SCHEMBL1597913 0.73 ATM (0.51) GAAMGAMSIMGAM2ATM

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
US-8399483-B2 Quinoxaline and quinoline derivatives as kinase inhibitors UCB PHARMA S.A. (BE) 2013-03-19 US disclosed
US-20110105508-A1 QUINOXALINE AND QUINOLINE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA, S.A. (BE) 2011-05-05 US disclosed
EP-2231641-A2 QUINOXALINE AND QUINOLINE DERIVATIVES AS KINASE INHIBITORS UCB Pharma, S.A. (BE) 2010-09-29 EP disclosed
WO-2009081105-A2 QUINOXALINE AND QUINOLINE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-07-02 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-20110105508-A1 QUINOXALINE AND QUINOLINE DERIVATIVES AS KINASE INHIBITORS PDXK, PDPK1, PIKFYVE KDR 787/4885GAA 1142/4885MGAM 1742/4885

“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.