SCHEMBL18934568

SCHEMBL18934568

Nc1cc(-n2c(=O)n(-c3ccccc3)c3ccccc32)c(N)cc1-n1c(=O)n(-c2ccccc2)c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3A P49840 3/20 0.41
▸ GSK3B P49841 3/20 0.41
▸ MAPK8 P45983 2/20 0.41
▸ HTR7 P34969 2/20 0.40
▸ PGR P06401 2/20 0.40
▸ MAPK9 P45984 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ GAA P10253 1/20 0.38
▸ PDE1B Q01064 1/20 0.38
▸ PDE3A Q14432 1/20 0.38
▸ PDE11A Q9HCR9 1/20 0.38
▸ SLC6A2 P23975 2/20 0.38
▸ SLC6A4 P31645 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ MAT2A P31153 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
SCHEMBL18934549 0.95 GSK3A (0.40) GSK3AGSK3BMAPK8HTR7PGR
SCHEMBL20527922 0.84 ALDH1A1 (0.41) GSK3AGSK3BMAPK8HTR7PGR
SCHEMBL18934612 0.84 ALDH1A1 (0.38) GSK3AGSK3BMAPK8HTR7PGR
SCHEMBL18934355 0.84 NTRK1 (0.34) GSK3AGSK3BMAPK8HTR7PGR
SCHEMBL18934889 0.84 SLC6A2 (0.39) GSK3AGSK3BMAPK8HTR7PGR
SCHEMBL18934550 0.83 HTR7 (0.38) GSK3AGSK3BMAPK8HTR7PGR
SCHEMBL6362698 0.82 GSK3A (0.56) GSK3AGSK3BMAPK8HTR7PGR
SCHEMBL18934691 0.82 KDM4E (0.46) MAPK8PGRMAPK9KDM4EATM
SCHEMBL18934336 0.81 GAA (0.43) GSK3AGSK3BMAPK8PGRMAPK9
SCHEMBL12251954 0.80 GSK3A (0.54) GSK3AGSK3BMAPK8HTR7PGR

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-11174258-B2 Benzimidazolo[1,2-a]benzimidazole derivatives for organic light emitting diodes IDEMITSU KOSAN CO., LTD. (JP) 2021-11-16 — — US disclosed
WO-2017093958-A1 BENZIMIDAZOLO[1,2-A]BENZIMIDAZOLE DERIVATIVES FOR ORGANIC LIGHT EMITTING DIODES IDEMITSU KOSAN CO., LTD. (JP) 2017-06-08 — — 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-11174258-B2 Benzimidazolo[1,2-a]benzimidazole derivatives for organic light emitting diodes KCNH2, KCNH3, KCNJ2 GSK3A 4175/4885GSK3B 3773/4885MAPK8 4202/4885

“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.

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