SCHEMBL5582307

SCHEMBL5582307

CNc1ncc2c(-c3cccc(Cl)c3)ccc(OC)c2n1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 6/20 0.41
FYN P06241 2/20 0.41
ALDH1A1 P00352 1/20 0.40
NPC1 O15118 1/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PDE4D Q08499 2/20 0.40
NUDT1 P36639 1/20 0.40
CSNK2A2 P19784 1/20 0.40
CSNK2B P67870 1/20 0.40
CSNK2A1 P68400 1/20 0.40
MAPK10 P53779 1/20 0.40
SCN9A Q15858 2/20 0.40
ADORA1 P30542 1/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 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
SCHEMBL5582334 0.89 ALDH1A1 (0.40) ALDH1A1PDE4DCSNK2A2CSNK2BCSNK2A1
SCHEMBL5581743 0.86 ALDH1A1 (0.40) PDE4BALDH1A1NPC1PDE4D
SCHEMBL5582151 0.86 KIT (0.47) PDE4BFYNSCN9A
SCHEMBL5581786 0.85 ALDH1A1 (0.41) ALDH1A1MAPTSMN1; SMN2SCN9AJAK2
SCHEMBL5582243 0.85 IDO1 (0.42) NPC1ADORA1
SCHEMBL5581811 0.85 PDGFRB (0.43) ALDH1A1MAPK10SCN9AADORA1
SCHEMBL5581749 0.84 FYN (0.43) FYNCSNK2A1SCN9AADORA1
SCHEMBL5582014 0.83 DHFR (0.54) PDE4BFYNNPC1MAPTTSHR
SCHEMBL5582253 0.83 KIT (0.49) ALDH1A1TSHRPDE4DSCN9AADORA1
SCHEMBL5582146 0.83 JAK3 (0.43) PDE4BALDH1A1SMN1; SMN2SCN9AJAK2

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-20070225308-A1 2-Amino Quinazoline Derivative KYOWA HAKKO KOGYO CO.,LTD. (JP) 2007-09-27 US disclosed
EP-1726584-A1 2-AMINOQUINAZOLINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-11-29 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-20070225308-A1 2-Amino Quinazoline Derivative AGTR2, ABL1, AGTR1 PDE4B 1056/4885FYN 2211/4885ALDH1A1 1519/4885

“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.