SCHEMBL16500883

SCHEMBL16500883

C=C/C=C(\C=C)c1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4ccc5oc6ccc(-c7ccc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)cc7)cc6c5c4)cc3)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TSPO P30536 1/20 0.34
▸ PTGER4 P35408 7/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PIK3CD O00329 1/20 0.31
▸ PIK3R1 P27986 1/20 0.31
▸ PIK3CA P42336 1/20 0.31
▸ PIK3CB P42338 1/20 0.31
▸ MTOR P42345 1/20 0.31
▸ PIK3CG P48736 1/20 0.31
▸ BTK Q06187 1/20 0.31

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
SCHEMBL16511361 0.86 TSPO (0.36) TSPOPTGER4
SCHEMBL17122335 0.85 L3MBTL1 (0.45) TSPOPTGER4KDM4EATML3MBTL1
SCHEMBL30570842 0.85 L3MBTL1 (0.45) TSPOPTGER4KDM4EATML3MBTL1
SCHEMBL10307134 0.85 L3MBTL1 (0.45) TSPOPTGER4KDM4EATML3MBTL1
SCHEMBL16500926 0.85 L3MBTL1 (0.45) TSPOPTGER4KDM4EATML3MBTL1
SCHEMBL17122324 0.85 L3MBTL1 (0.45) TSPOPTGER4KDM4EATML3MBTL1
SCHEMBL17122337 0.85 L3MBTL1 (0.45) TSPOPTGER4KDM4EATML3MBTL1
SCHEMBL17122329 0.85 L3MBTL1 (0.45) TSPOPTGER4KDM4EATML3MBTL1
SCHEMBL17122320 0.85 L3MBTL1 (0.45) TSPOPTGER4KDM4EATML3MBTL1
SCHEMBL10307144 0.85 L3MBTL1 (0.45) TSPOPTGER4KDM4EATML3MBTL1

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-20110297924-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2011-12-08 — — US disclosed
US-20110297924-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2011-12-08 — — 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-20110297924-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT SLC18A2, SLC18A1, SLC7A5 TSPO 798/4885PTGER4 3882/4885KDM4E 214/4885

“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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