SCHEMBL3717067

SCHEMBL3717067

CN1CCc2[nH]c3ccncc3c2C1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.58
HTR6 P50406 5/20 0.58
ALOX15 P16050 2/20 0.54
HSD17B10 Q99714 2/20 0.54
USP2 O75604 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
SIRT2 Q8IXJ6 1/20 0.51
POLB P06746 2/20 0.49
GAA P10253 1/20 0.49
KDM4E B2RXH2 2/20 0.49
DRD2 P14416 1/20 0.48
DRD1 P21728 1/20 0.48
DRD4 P21917 1/20 0.48
DRD5 P21918 1/20 0.48
DRD3 P35462 1/20 0.48
ALDH1A1 P00352 1/20 0.47
MAPK1 P28482 1/20 0.47

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
SCHEMBL12951291 0.88 KDM4E (0.64) CHRNA7L3MBTL1HTR6ALOX15HSD17B10
SCHEMBL3715769 0.88 CHRNA7 (0.64) CHRNA7L3MBTL1HTR6ALOX15HSD17B10
SCHEMBL30324538 0.78 CHRNA7 (1.00) CHRNA7L3MBTL1HTR6ALOX15HSD17B10
SCHEMBL168248 0.78 CHRNA7 (1.00) CHRNA7L3MBTL1HTR6ALOX15HSD17B10
SCHEMBL801112 0.75 HTR6 (0.77) CHRNA7L3MBTL1HTR6ALOX15HSD17B10
Dehydrostobadine SCHEMBL167500 0.75 L3MBTL1 (0.97) CHRNA7L3MBTL1HTR6ALOX15HSD17B10
Dehydrostobadine SCHEMBL29468212 0.75 L3MBTL1 (0.97) CHRNA7L3MBTL1HTR6ALOX15HSD17B10
SCHEMBL2222493 0.74 MAPT (0.47) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL801464 0.74 HTR6 (1.00) CHRNA7L3MBTL1HTR6ALOX15HSD17B10
SCHEMBL19252850 0.73 L3MBTL1 (0.70) CHRNA7L3MBTL1HTR6ALOX15HSD17B10

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 CHRNA7 129/4885L3MBTL1 3804/4885HTR6 10/4885
US-20130131054-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A CHRNA7 129/4885L3MBTL1 3804/4885HTR6 10/4885
US-20130203746-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A CHRNA7 129/4885L3MBTL1 3804/4885HTR6 10/4885
US-20130190304-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A CHRNA7 129/4885L3MBTL1 3804/4885HTR6 10/4885
US-20090239854-A1 Tetracyclic compounds HTR2C, HTR3D, HTR5A CHRNA7 129/4885L3MBTL1 3804/4885HTR6 10/4885
US-20140194414-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A CHRNA7 129/4885L3MBTL1 3804/4885HTR6 10/4885

“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.