SCHEMBL2642324

SCHEMBL2642324

Cc1nc(-c2cccc(F)c2F)no1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.51
NPC1 O15118 7/20 0.51
RAB9A P51151 7/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
GAA P10253 2/20 0.51
PDK2 Q15119 1/20 0.48
KMT2A Q03164 3/20 0.45
NFKB1 P19838 3/20 0.45
NFKB2 Q00653 3/20 0.45
RELA Q04206 3/20 0.45
MEN1 O00255 2/20 0.45
TUBB4A P04350 4/20 0.44
TUBB P07437 4/20 0.44
TUBA3C P0DPH7 4/20 0.44
TUBA1B P68363 4/20 0.44
TUBA4A P68366 4/20 0.44
TUBB4B P68371 4/20 0.44
TUBB3 Q13509 4/20 0.44
TUBB2A Q13885 4/20 0.44
TUBB8 Q3ZCM7 4/20 0.44

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
SCHEMBL11921136 0.86 L3MBTL1 (0.51) L3MBTL1NPC1RAB9ASMN1; SMN2GAA
SCHEMBL12266888 0.86 L3MBTL1 (0.51) L3MBTL1NPC1RAB9ASMN1; SMN2GAA
SCHEMBL2642358 0.83 NPC1 (0.49) L3MBTL1NPC1RAB9ASMN1; SMN2GAA
SCHEMBL2642361 0.83 PDK2 (0.49) L3MBTL1NPC1RAB9ASMN1; SMN2GAA
SCHEMBL16067420 0.81 NPC1 (0.50) L3MBTL1NPC1RAB9ASMN1; SMN2GAA
SCHEMBL18195996 0.81 PDK2 (0.47) L3MBTL1NPC1RAB9ASMN1; SMN2GAA
SCHEMBL11921135 0.80 NPC1 (0.46) L3MBTL1NPC1RAB9ASMN1; SMN2GAA
SCHEMBL6901661 0.79 NPC1 (0.51) L3MBTL1NPC1RAB9ASMN1; SMN2GAA
SCHEMBL17071973 0.79 PDK2 (0.45) L3MBTL1NPC1RAB9ASMN1; SMN2GAA
SCHEMBL16067417 0.77 SMN1; SMN2 (0.50) L3MBTL1NPC1RAB9ASMN1; SMN2GAA

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
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
EP-1734040-A1 SUBSTITUTED QUINAZOLINE OR PYRIDOPYRIMIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-12-20 EP 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 L3MBTL1 4584/4885NPC1 3557/4885RAB9A 1818/4885

“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.