SCHEMBL19768331

SCHEMBL19768331

c1ccc(-c2cc(-c3ccc(-c4ccc5ccc6ccc(-c7ccc(-c8ccc9c%10c(cccc8%10)-c8ccccc8-9)cc7)nc6c5n4)cc3)cc(-c3ccccn3)n2)nc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.38
▸ MAPK1 P28482 4/20 0.38
▸ CCR1 P32246 3/20 0.38
▸ CCR5 P51681 3/20 0.38
▸ CCR8 P51685 3/20 0.38
▸ TP53 P04637 3/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ L3MBTL1 Q9Y468 3/20 0.38
▸ LMNA P02545 3/20 0.38
▸ ALOX15 P16050 2/20 0.38
▸ HTT P42858 2/20 0.38
▸ ALPL P05186 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.38
▸ ALPI P09923 1/20 0.38
▸ ALPG P10696 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ SQOR Q9Y6N5 2/20 0.35
▸ DHODH Q02127 1/20 0.34
▸ PDK2 Q15119 1/20 0.34
▸ MEN1 O00255 3/20 0.33

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
SCHEMBL19768267 0.92 KDM4E (0.42) KDM4EMAPK1CCR1CCR5CCR8
SCHEMBL19768303 0.91 DHODH (0.38) KDM4EMAPK1CCR1CCR5CCR8
SCHEMBL23712271 0.91 KDM4E (0.46) KDM4EMAPK1CCR1CCR5CCR8
SCHEMBL26906408 0.91 KDM4E (0.46) KDM4EMAPK1CCR1CCR5CCR8
SCHEMBL19768306 0.86 PRKDC (0.38) KDM4EMAPK1CCR1CCR5CCR8
SCHEMBL19768057 0.86 DHODH (0.38) KDM4EMAPK1CCR1CCR5CCR8
SCHEMBL24626223 0.85 HPGDS (0.41) KDM4EMAPK1CCR1CCR5CCR8
SCHEMBL23081976 0.85 HPGDS (0.41) KDM4EMAPK1CCR1CCR5CCR8
SCHEMBL19768093 0.85 HTR2C (0.43) KDM4EMAPK1CCR1CCR5CCR8
SCHEMBL19768265 0.85 KDM4E (0.41) KDM4EMAPK1CCR1CCR5CCR8

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-20180019407-A1 PHENANTHROLINE DERIVATIVE, ELECTRONIC DEVICE CONTAINING SAME, LIGHT EMITTING ELEMENT, AND PHOTOELECTRIC CONVERSION ELEMENT TORAY INDUSTRIES, INC (JP) 2018-01-18 — — US disclosed
US-20180019407-A1 PHENANTHROLINE DERIVATIVE, ELECTRONIC DEVICE CONTAINING SAME, LIGHT EMITTING ELEMENT, AND PHOTOELECTRIC CONVERSION ELEMENT TORAY INDUSTRIES, INC (JP) 2018-01-18 — — 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-20180019407-A1 PHENANTHROLINE DERIVATIVE, ELECTRONIC DEVICE CONTAINING SAME, LIGHT EMITTING ELEMENT, AND PHOTOELECTRIC CONVERSION ELEMENT SUN2, PAH, FARS2 KDM4E 488/4885MAPK1 3270/4885CCR1 4606/4885

“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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