SCHEMBL16596206

SCHEMBL16596206

O=S(=O)(Oc1ccc(N(c2ccc(-c3cccc4c3oc3ccccc34)cc2)c2ccc(-c3cccc4c3sc3ccccc34)cc2)cc1)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 7/20 0.36
▸ ALOX5 P09917 2/20 0.35
▸ PIK3CD O00329 2/20 0.33
▸ PIK3CB P42338 2/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ PIK3CA P42336 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ PIK3CG P48736 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ BRDT Q58F21 1/20 0.33
▸ CDC14B O60729 2/20 0.32
▸ CDC14A Q9UNH5 2/20 0.32
▸ PTGES2 Q9H7Z7 1/20 0.32
▸ GGPS1 O95749 1/20 0.32
▸ PARP14 Q460N5 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
SCHEMBL16596366 0.99 PRKDC (0.35) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL16596209 0.90 ALOX5 (0.43) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL16596312 0.90 ALOX5 (0.43) PRKDCALOX5PIK3CDPIK3CBCDC14B
SCHEMBL16596207 0.89 ALOX5 (0.42) PRKDCALOX5PIK3CDPIK3CBCDC14B
SCHEMBL15964403 0.86 ALOX5 (0.44) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL17126813 0.86 ALOX5 (0.46) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL17126812 0.86 ALOX5 (0.46) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL24434242 0.85 ALOX5 (0.43) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL17412445 0.85 ALOX5 (0.43) PRKDCALOX5PIK3CDPIK3CBBRD4
SCHEMBL15964402 0.85 ALOX5 (0.43) PRKDCALOX5PIK3CDPIK3CBBRD4

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-9425402-B2 Polymerizable monomer, and material for organic device, hole injection/transport material, material for organic electroluminescence element and organic electroluminescent element each comprising polymer (polymeric compound) of the polymerizable monomer IDEMITSU KOSAN CO., LTD. (JP) 2016-08-23 — — US disclosed
US-20150084031-A1 NOVEL POLYMERIZABLE MONOMER, AND MATERIAL FOR ORGANIC DEVICE, HOLE INJECTION/TRANSPORT MATERIAL, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT AND ORGANIC ELECTROLUMINESCENT ELEMENT EACH COMPRISING POLYMER (POLYMERIC COMPOUND) OF THE POLYMERIZABLE MONOMER IDEMITSU KOSAN CO (JP) 2015-03-26 — — 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-20150084031-A1 NOVEL POLYMERIZABLE MONOMER, AND MATERIAL FOR ORGANIC DEVICE, HOLE INJECTION/TRANSPORT MATERIAL, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT AND ORGANIC ELECTROLUMINESCENT ELEMENT EACH COMPRISING POLYMER (POLYMERIC COMPOUND) OF THE POLYMERIZABLE MONOMER EPB41, USE1, EPB41L2 PRKDC 4823/4885ALOX5 919/4885PIK3CD 4201/4885

“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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