SCHEMBL2646676

SCHEMBL2646676

OCCc1ccc(Sc2cnc3sc(Nc4ncnc5ccccc45)nc3c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.37
HTT P42858 4/20 0.37
LMNA P02545 2/20 0.37
APP P05067 1/20 0.37
MAPK1 P28482 1/20 0.37
ABCG2 Q9UNQ0 5/20 0.36
GLA P06280 1/20 0.36
AURKB Q96GD4 2/20 0.36
DAPK3 O43293 1/20 0.36
MAP4K4 O95819 1/20 0.36
ABL1 P00519 1/20 0.36
ERBB2 P04626 1/20 0.36
PIM1 P11309 1/20 0.36
PRKACA P17612 1/20 0.36
LTK P29376 1/20 0.36
MAPK8 P45983 1/20 0.36
CSNK1A1 P48729 1/20 0.36
RPS6KA3 P51812 1/20 0.36
LIMK1 P53667 1/20 0.36
MAP2K1 Q02750 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
SCHEMBL2642040 0.83 KMT2A (0.39) EGFRHTTLMNAABCG2GLA
SCHEMBL2642645 0.78 ABCG2 (0.38) EGFRHTTMAPK1ABCG2GLA
SCHEMBL2642215 0.78 NSD2 (0.39) EGFRHTTLMNAABCG2GLA
SCHEMBL2646673 0.77 ABCG2 (0.38) EGFRHTTMAPK1ABCG2GLA
SCHEMBL2642160 0.77 MET (0.39) EGFRHTTABCG2GLAAURKB
SCHEMBL2646674 0.72 GCK (0.39) EGFRLMNAMAPK1AURKBDYRK1A
SCHEMBL2642043 0.70 GCK (0.40) EGFRHTTLMNAMAPK1ABCG2
SCHEMBL2642798 0.69 GCK (0.42) EGFRSMN1; SMN2GCKRAB9A
SCHEMBL2642210 0.66 GCK (0.46) EGFRHTTLMNAMAPK1ERBB2
SCHEMBL2642489 0.66 GCK (0.43) EGFRHTTLMNAMAPK1ABCG2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7687502-B2 Substituted quinazoline or pyridopyrimidine derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-03-30 US disclosed
US-20080032996-A1 Substituted Quinazoline or Pyridopyrimidine Derivative MSD K.K. (JP) 2008-02-07 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-20080032996-A1 Substituted Quinazoline or Pyridopyrimidine Derivative GCK, GCKR, PDXK EGFR 3484/4885HTT 3974/4885LMNA 4577/4885

“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.