SCHEMBL3724766

SCHEMBL3724766

CCCCN1CCc2[nH]c3ccc(C)cc3c2C1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.86
GRIN1 Q05586 3/20 0.86
GRIN2A Q12879 3/20 0.86
GRIN2D O15399 2/20 0.86
GRIN3B O60391 2/20 0.86
GRIN2B Q13224 2/20 0.86
GRIN2C Q14957 2/20 0.86
GRIN3A Q8TCU5 2/20 0.86
L3MBTL1 Q9Y468 1/20 0.64
SMN1; SMN2 Q16637 2/20 0.58
LMNA P02545 1/20 0.58
PABPC1 P11940 1/20 0.58
ATM Q13315 1/20 0.58
BAZ2B Q9UIF8 1/20 0.56
HDAC1 Q13547 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
NPC1 O15118 2/20 0.55
ALDH1A1 P00352 1/20 0.55
HPGD P15428 1/20 0.55
RAB9A P51151 1/20 0.55

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
SCHEMBL2246410 0.96 ACHE (0.88) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL7137991 0.89 ACHE (0.84) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL2188478 0.89 ACHE (0.84) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL20145397 0.89 ACHE (0.75) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL2188030 0.87 ACHE (0.76) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL2189750 0.86 ACHE (0.79) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL7134093 0.83 ACHE (0.73) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL16387807 0.81 ACHE (0.69) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL2192272 0.80 ACHE (0.70) ACHEGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL168487 0.80 ACHE (0.70) ACHEGRIN1GRIN2AGRIN2DGRIN3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9181240-B2 Tetracyclic compounds MEDIVATION TECHNOLOGIES, INC. (US) 2015-11-10 US disclosed
US-9096591-B2 Tetracyclic compounds MEDIVATION TECHNOLOGIES, INC. (US) 2015-08-04 US disclosed
US-20150182509-A1 TETRACYCLIC COMPOUNDS MEDIVATION TECHNOLOGIES, INC. 2015-07-02 US disclosed
US-9034880-B2 Tetracyclic compounds MEDIVATION TECHNOLOGIES, INC. (US) 2015-05-19 US disclosed
US-8999978-B2 Tetracyclic compounds MEDIVATION TECHNOLOGIES, INC. (US) 2015-04-07 US disclosed
US-20140194414-A1 TETRACYCLIC COMPOUNDS MEDIVATION TECHNOLOGIES, INC. (US) 2014-07-10 US disclosed
US-20130203746-A1 TETRACYCLIC COMPOUNDS MEDIVATION TECHNOLOGIES INC. 2013-08-08 US disclosed
US-20130190304-A1 TETRACYCLIC COMPOUNDS MEDIVATION TECHNOLOGIES, INC. (US) 2013-07-25 US disclosed
US-20130131054-A1 TETRACYCLIC COMPOUNDS MEDIVATION TECHNOLOGIES, INC. (US) 2013-05-23 US disclosed
US-8338408-B2 Tetracyclic compounds MEDIVATION TECHNOLOGIES, INC. (US) 2012-12-25 US disclosed
EP-2217598-A1 NEW TETRACYCLIC COMPOUNDS Medivation Technologies, Inc. (US) 2010-08-18 EP disclosed
US-20090239854-A1 Tetracyclic compounds MEDIVATION TECHNOLOGIES, INC. 2009-09-24 US disclosed
WO-2009055828-A1 NEW TETRACYCLIC COMPOUNDS MEDIVATION TECHNOLOGIES, INC. (US) 2009-04-30 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 (6 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-20150182509-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A ACHE 240/4885GRIN1 55/4885GRIN2A 28/4885
US-20130131054-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A ACHE 240/4885GRIN1 55/4885GRIN2A 28/4885
US-20130203746-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A ACHE 240/4885GRIN1 55/4885GRIN2A 28/4885
US-20130190304-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A ACHE 240/4885GRIN1 55/4885GRIN2A 28/4885
US-20090239854-A1 Tetracyclic compounds HTR2C, HTR3D, HTR5A ACHE 240/4885GRIN1 55/4885GRIN2A 28/4885
US-20140194414-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A ACHE 240/4885GRIN1 55/4885GRIN2A 28/4885

“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.