SCHEMBL30828787

SCHEMBL30828787

c1cnc2ccc(-c3cnn(C4CC4)c3)cc2c1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MET P08581 10/20 0.62
EGFR P00533 1/20 0.58
ERBB2 P04626 1/20 0.58
ERBB4 Q15303 1/20 0.58
NPC1 O15118 1/20 0.57
POLB P06746 1/20 0.57
RAB9A P51151 1/20 0.57
PIK3CD O00329 1/20 0.55
PIK3CA P42336 1/20 0.55
PIK3CB P42338 1/20 0.55
PI4KA P42356 1/20 0.55
PIK3CG P48736 1/20 0.55
PI4KB Q9UBF8 1/20 0.55
ALK Q9UM73 5/20 0.49
DYRK1A Q13627 1/20 0.48
RIPK1 Q13546 1/20 0.47

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
SCHEMBL22048959 0.80 MET (0.65) METEGFRERBB2ERBB4NPC1
SCHEMBL29757180 0.75 NPC1 (1.00) NPC1POLBRAB9APIK3CDPIK3CA
SCHEMBL30743 0.75 NPC1 (1.00) NPC1POLBRAB9APIK3CDPIK3CA
SCHEMBL30468943 0.74 EGFR (0.48) METEGFRERBB2ERBB4DYRK1A
SCHEMBL30695495 0.73 PIK3CD (0.55) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL22119811 0.73 DPP4 (0.54) METEGFRERBB2ERBB4PIK3CD
SCHEMBL21876272 0.71 PIK3CD (0.53) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL29369075 0.71 PIK3CD (0.53) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL30142182 0.70 CNR2 (0.44) METALK
SCHEMBL23048839 0.70 DYRK1A (0.61) DYRK1A

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
US-20240101549-A1 N-(2-(4-CYANOTHIAZOLIDIN-3-YL)-2-OXOETHYL)-QUINOLINE-4-CARBOXAMIDES ASTRAZENECA AB (SE) 2024-03-28 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-20240101549-A1 N-(2-(4-CYANOTHIAZOLIDIN-3-YL)-2-OXOETHYL)-QUINOLINE-4-CARBOXAMIDES FAP, PREP, CTRL MET 1203/4885EGFR 1749/4885ERBB2 2283/4885

“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.