SCHEMBL18416092

SCHEMBL18416092

c1ccc(N(c2cc3ccc4ccc(N(c5ccccc5)c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c5ccc(c2)c3c45)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ ERBB2 P04626 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ FYN P06241 1/20 0.31
▸ MAOA P21397 1/20 0.31
▸ ACHE P22303 1/20 0.31
▸ AHR P35869 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ BRCA1 P38398 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL18416110 0.94 KDM4E (0.41) KDM4EATML3MBTL1ERBB2CYP1A2
SCHEMBL14848517 0.94 KDM4E (0.45) KDM4EATML3MBTL1MEN1ALDH1A1
SCHEMBL18416088 0.91 KDM4E (0.39) KDM4EATML3MBTL1ERBB2CYP1A2
SCHEMBL14848579 0.90 KDM4E (0.43) KDM4EATML3MBTL1ERBB2CYP1A2
SCHEMBL7248759 0.90 L3MBTL1 (0.35) KDM4EATML3MBTL1ERBB2CYP1A2
SCHEMBL18416098 0.89 KDM4E (0.33) KDM4EATML3MBTL1ALDH1A1
SCHEMBL18416099 0.89 KDM4E (0.33) KDM4EATML3MBTL1ALDH1A1
SCHEMBL20349159 0.89 KDM4E (0.40) KDM4EATML3MBTL1MEN1ALDH1A1
SCHEMBL16271369 0.87 KDM4E (0.41) KDM4EATML3MBTL1ERBB2CYP1A2
SCHEMBL15686433 0.87 KDM4E (0.47) KDM4EATML3MBTL1CYP1A2MEN1

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-20170029362-A1 LUMINESCENT COMPOUNDS E. I. DU PONT DE NEMOURS AND COMPANY 2017-02-02 — — US disclosed
US-20170029362-A1 LUMINESCENT COMPOUNDS E. I. DU PONT DE NEMOURS AND COMPANY 2017-02-02 — — 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 (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-20170029362-A1 LUMINESCENT COMPOUNDS AHR, CCNL2, ARNT KDM4E 1362/4885ATM 3365/4885L3MBTL1 615/4885

“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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