SCHEMBL28478447

SCHEMBL28478447

Oc1ccc2cncnc2c1O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
P4HB P07237 2/20 0.42
EGFR P00533 9/20 0.38
LCK P06239 2/20 0.35
PTPN22 Q9Y2R2 1/20 0.34
ERN1 O75460 2/20 0.33
FGFR1 P11362 1/20 0.33
SRC P12931 1/20 0.33
TRPV1 Q8NER1 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPKAPK2 P49137 1/20 0.31

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
SCHEMBL13271229 0.80 P4HB (0.46) P4HBEGFRERN1TRPV1KDM4E
SCHEMBL3239306 0.80 P4HB (0.40) P4HBEGFRKDM4E
SCHEMBL25850566 0.79 EGFR (0.48) P4HBEGFRTRPV1KDM4E
SCHEMBL13313256 0.76 ALDH1A1 (0.58) ERN1KDM4E
SCHEMBL276426 0.75 METAP2 (0.55) EGFRTRPV1KDM4EMAPKAPK2
SCHEMBL3265420 0.74 RPS6KB1 (0.43)
SCHEMBL13406017 0.74 P4HB (0.37) P4HBEGFRTRPV1
SCHEMBL13313265 0.74 EGLN1 (0.42) P4HB
Hydrochloric Acid SCHEMBL28754132 0.73 METAP2 (0.53) EGFRTRPV1KDM4EMAPKAPK2
SCHEMBL13406059 0.72 P4HB (0.36) P4HBEGFRERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108383849-B Imidazoquinazoline derivative and application thereof in anti-tumor and anti-inflammation 浙江大学 2020-11-06 CN disclosed