SCHEMBL22674196

SCHEMBL22674196

c1ccc(-c2nc3ccccn3c2-c2ccc(-c3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 12/20 0.48
AKT2 P31751 11/20 0.48
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KDM4E B2RXH2 2/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ADRA1B P35368 1/20 0.38
NTRK1 P04629 1/20 0.38
NR1I2 O75469 1/20 0.38
NR1I3 Q14994 1/20 0.38
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL22673528 1.00 AKT1 (0.48) AKT1AKT2NPC1RAB9AKDM4E
SCHEMBL22673333 0.98 AKT1 (0.46) AKT1AKT2NPC1RAB9AKDM4E
SCHEMBL22673676 0.98 AKT1 (0.46) AKT1AKT2NPC1RAB9AKDM4E
SCHEMBL24479219 0.94 AKT1 (0.46) AKT1AKT2NPC1RAB9AKDM4E
SCHEMBL22673510 0.94 AKT1 (0.46) AKT1AKT2NPC1RAB9AKDM4E
SCHEMBL24479248 0.94 AKT1 (0.47) AKT1AKT2NPC1RAB9AKDM4E
SCHEMBL22673504 0.94 AKT1 (0.47) AKT1AKT2NPC1RAB9AKDM4E
SCHEMBL9888855 0.94 AKT1 (0.53) AKT1AKT2NPC1RAB9AKDM4E
SCHEMBL9888885 0.94 AKT1 (0.53) AKT1AKT2NPC1RAB9AKDM4E
SCHEMBL19928021 0.93 AKT1 (0.48) AKT1AKT2NPC1RAB9AKDM4E

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-20220169661-A1 IMIDAZO NITROGEN HETEROCYCLIC COMPOUND AND APPLICATION THEREOF GUANGDONG AGLAIA OPTOELECTRONIC MATERIALS CO., LTD (CN) 2022-06-02 US disclosed
WO-2020228430-A1 IMIDAZO NITROGEN HETEROCYCLIC COMPOUND AND APPLICATION THEREOF 广东阿格蕾雅光电材料有限公司 2020-11-19 WO 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-20220169661-A1 IMIDAZO NITROGEN HETEROCYCLIC COMPOUND AND APPLICATION THEREOF HCN4, IPO8, HCN1 AKT1 2630/4885AKT2 2749/4885NPC1 461/4885

“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.