SCHEMBL22177316

SCHEMBL22177316

c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4cccc5sc6cc(-c7ccc(-c8nc9ccccc9s8)cc7)ccc6c45)n3)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 5/20 0.46
▸ MMP9 P14780 2/20 0.45
▸ MMP8 P22894 2/20 0.45
▸ RAB9A P51151 8/20 0.43
▸ KDM4E B2RXH2 5/20 0.43
▸ NPC1 O15118 5/20 0.43
▸ SMN1; SMN2 Q16637 5/20 0.43
▸ MAPT P10636 4/20 0.43
▸ NFKB1 P19838 4/20 0.43
▸ NFKB2 Q00653 4/20 0.43
▸ RELA Q04206 4/20 0.43
▸ LMNA P02545 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ PAX8 Q06710 1/20 0.43
▸ NOD2 Q9HC29 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ POLB P06746 1/20 0.43

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
SCHEMBL22177732 0.98 APP (0.46) APPMMP9MMP8RAB9AKDM4E
SCHEMBL22177773 0.98 APP (0.46) APPMMP9MMP8RAB9AKDM4E
SCHEMBL22177745 0.98 APP (0.46) APPMMP9MMP8RAB9AKDM4E
SCHEMBL22177323 0.98 APP (0.48) APPMMP9MMP8RAB9AKDM4E
SCHEMBL22177317 0.98 APP (0.48) APPMMP9MMP8RAB9AKDM4E
SCHEMBL22177769 0.97 APP (0.47) APPMMP9MMP8RAB9AKDM4E
SCHEMBL22177881 0.96 APP (0.45) APPMMP9MMP8RAB9AKDM4E
SCHEMBL22177884 0.96 APP (0.46) APPMMP9MMP8RAB9AKDM4E
SCHEMBL22177753 0.96 APP (0.48) APPMMP9MMP8RAB9AKDM4E
SCHEMBL22177341 0.95 APP (0.49) APPMMP9MMP8RAB9AKDM4E

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-11518769-B2 Heterocyclic compounds and organic light emitting device using the same LG CHEM, LTD. (KR) 2022-12-06 — — US disclosed
US-20200207754-A1 NOVEL HETEROCYCLIC COMPOUNDS AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME LG CHEM, LTD. (KR) 2020-07-02 — — 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 (2 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-20200207754-A1 NOVEL HETEROCYCLIC COMPOUNDS AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME CRY1, CRY2, CYP1A1 APP 864/4885MMP9 4002/4885MMP8 4839/4885
US-11518769-B2 Heterocyclic compounds and organic light emitting device using the same CRY1, CYP1A1, CRY2 APP 660/4885MMP9 4027/4885MMP8 4836/4885

“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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