SCHEMBL22177675

SCHEMBL22177675

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5sc6cccc(-c7ccc(-c8nc9ccccc9s8)cc7)c6c45)n3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 5/20 0.54
▸ MMP9 P14780 3/20 0.54
▸ MMP8 P22894 3/20 0.54
▸ RAB9A P51151 9/20 0.50
▸ NPC1 O15118 6/20 0.50
▸ KDM4E B2RXH2 5/20 0.50
▸ MAPT P10636 5/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ GAA P10253 3/20 0.50
▸ LMNA P02545 2/20 0.50
▸ GLA P06280 2/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ PAX8 Q06710 1/20 0.50
▸ NOD2 Q9HC29 1/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ NFKB1 P19838 3/20 0.47
▸ NFKB2 Q00653 3/20 0.47
▸ RELA Q04206 3/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 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
SCHEMBL22177674 0.99 APP (0.55) APPMMP9MMP8RAB9ANPC1
SCHEMBL22177673 0.95 APP (0.49) APPMMP9MMP8RAB9ANPC1
SCHEMBL22178104 0.94 APP (0.55) APPMMP9MMP8RAB9ANPC1
SCHEMBL22177632 0.93 APP (0.49) APPMMP9MMP8RAB9ANPC1
SCHEMBL22177680 0.93 RAB9A (0.51) APPMMP9MMP8RAB9ANPC1
SCHEMBL22177536 0.92 RAB9A (0.49) APPMMP9MMP8RAB9ANPC1
SCHEMBL22177644 0.92 RAB9A (0.49) APPMMP9MMP8RAB9ANPC1
SCHEMBL22177681 0.91 RAB9A (0.52) APPMMP9MMP8RAB9ANPC1
SCHEMBL22178377 0.91 RAB9A (0.50) APPMMP9MMP8RAB9ANPC1
SCHEMBL22177682 0.90 RAB9A (0.49) APPMMP9MMP8RAB9ANPC1

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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