SCHEMBL10057545

SCHEMBL10057545

CC1(C)c2ccccc2-c2cc(-c3ccc4c(c3)C(=O)c3ccc(-c5ccc6c(c5)-c5ccccc5C6(C)C)cc3C43c4ccccc4-c4ccccc43)ccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.38
▸ APAF1 O14727 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ XBP1 P17861 1/20 0.38
▸ PTBP1 P26599 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ GALK1 P51570 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ SMAD3 P84022 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ PDK2 Q15119 13/20 0.36
▸ PTPRC P08575 2/20 0.36

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
SCHEMBL10057973 0.99 NPC1 (0.39) MEN1APAF1NPC1LMNAMAPT
SCHEMBL10057457 0.94 MEN1 (0.39) MEN1APAF1NPC1LMNAMAPT
SCHEMBL10057537 0.94 MEN1 (0.43) MEN1APAF1NPC1LMNAMAPT
SCHEMBL10057982 0.92 MEN1 (0.44) MEN1APAF1NPC1LMNAMAPT
SCHEMBL12177771 0.91 NPC1 (0.42) MEN1APAF1NPC1LMNAMAPT
SCHEMBL12177773 0.90 MEN1 (0.43) MEN1APAF1NPC1LMNAMAPT
SCHEMBL12177813 0.89 MEN1 (0.42) MEN1APAF1NPC1LMNAMAPT
SCHEMBL10057539 0.88 PTPRC (0.36) MEN1APAF1NPC1LMNAMAPT
SCHEMBL10057458 0.87 MEN1 (0.44) MEN1APAF1NPC1LMNAMAPT
SCHEMBL12177884 0.87 MEN1 (0.42) MEN1APAF1NPC1LMNAMAPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160308129-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2016-10-20 — — US disclosed
US-20160308129-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2016-10-20 — — US disclosed
US-20130105786-A1 NOVEL SPIRO(ANTHRACENE-9,9'-FLUOREN)-10-ONE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-05-02 — — US disclosed
US-20130105786-A1 NOVEL SPIRO(ANTHRACENE-9,9'-FLUOREN)-10-ONE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-05-02 — — US disclosed
WO-2012008557-A1 NOVEL SPIRO (ANTHRACENE-9,9'-FLUOREN) -10-ONE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CANON KABUSHIKI KAISHA (JP) 2012-01-19 — — WO 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-20160308129-A1 MATERIALS FOR ELECTRONIC DEVICES EFNA1, GPX1, EPN1 MEN1 465/4885APAF1 3976/4885NPC1 2720/4885

“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.

Send feedback