SCHEMBL3663807

SCHEMBL3663807

O=C(O)C1CCN(C(=O)CCBr)CC1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.63
LMNA P02545 2/20 0.63
KMT2A Q03164 2/20 0.63
KDM4E B2RXH2 1/20 0.63
MEN1 O00255 1/20 0.63
USP2 O75604 1/20 0.63
CYP3A4 P08684 1/20 0.63
HPGD P15428 1/20 0.63
HSD17B10 Q99714 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
POLB P06746 2/20 0.57
L3MBTL1 Q9Y468 1/20 0.51
ITGB3 P05106 1/20 0.45
ITGA2B P08514 1/20 0.45
NPC1 O15118 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.40

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
SCHEMBL7277285 0.84 L3MBTL1 (0.54) ALDH1A1LMNAKMT2AKDM4EMEN1
SCHEMBL3788745 0.82 POLB (0.58) ALDH1A1LMNAPOLBL3MBTL1ITGB3
SCHEMBL5221546 0.81 POLB (0.57) LMNAPOLBL3MBTL1ITGB3ITGA2B
SCHEMBL3792382 0.81 POLB (0.61) ALDH1A1LMNATDP1POLBL3MBTL1
SCHEMBL15071468 0.81 POLB (0.57) ALDH1A1LMNAPOLBL3MBTL1ITGB3
SCHEMBL10039632 0.80 L3MBTL1 (0.54) ALDH1A1LMNAPOLBL3MBTL1ITGB3
SCHEMBL6526595 0.79 ALDH1A1 (0.56) ALDH1A1LMNAKMT2AKDM4EMEN1
SCHEMBL3664951 0.79 ALDH1A1 (0.50) ALDH1A1LMNAKMT2AKDM4EMEN1
Pipobroman SCHEMBL4889 0.79 MEN1 (1.00) ALDH1A1LMNAKMT2AKDM4EMEN1
Pipobroman SCHEMBL2351497 0.79 MEN1 (1.00) ALDH1A1LMNAKMT2AKDM4EMEN1

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 14 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
CN-101952284-A Novel tetracyclic compounds MEDIVATION TECHNOLOGIES INC 2011-01-19 CN 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 ALDH1A1 1557/4885LMNA 4777/4885KMT2A 434/4885
US-20130131054-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A ALDH1A1 1557/4885LMNA 4777/4885KMT2A 434/4885
US-20130203746-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A ALDH1A1 1557/4885LMNA 4777/4885KMT2A 434/4885
US-20130190304-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A ALDH1A1 1557/4885LMNA 4777/4885KMT2A 434/4885
US-20090239854-A1 Tetracyclic compounds HTR2C, HTR3D, HTR5A ALDH1A1 1557/4885LMNA 4777/4885KMT2A 434/4885
US-20140194414-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A ALDH1A1 1557/4885LMNA 4777/4885KMT2A 434/4885

“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.