SCHEMBL4127984

SCHEMBL4127984

CCc1cccn1CCBr

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 7/20 0.35
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL10512605 0.83 RAPGEF4 (0.37) RAPGEF4ALDH1A1
Hydrochloric Acid SCHEMBL30330950 0.81 RAPGEF4 (0.36) RAPGEF4ALDH1A1
Fluoride SCHEMBL30329730 0.81 RAPGEF4 (0.36) RAPGEF4ALDH1A1
SCHEMBL10515132 0.79 POLB (0.41) RAPGEF4ALDH1A1
SCHEMBL10536181 0.79 RAPGEF4 (0.35) RAPGEF4ALDH1A1
SCHEMBL543197 0.79 CA1 (0.36) RAPGEF4ALDH1A1
SCHEMBL668145 0.78
Hydrochloric Acid SCHEMBL30330458 0.78 TLR8 (0.41) RAPGEF4ALDH1A1
Cyanide SCHEMBL30330190 0.78 RAPGEF4 (0.34) RAPGEF4ALDH1A1
Fluoride SCHEMBL30212879 0.78 POLB (0.40) RAPGEF4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106188043-A Tetracyclic compound 梅迪维新技术公司 2016-12-07 CN disclosed
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-8999978-B2 Tetracyclic compounds MEDIVATION TECHNOLOGIES, INC. (US) 2015-04-07 US disclosed
US-20130203746-A1 TETRACYCLIC COMPOUNDS MEDIVATION TECHNOLOGIES INC. 2013-08-08 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
US-20090239854-A1 Tetracyclic compounds MEDIVATION TECHNOLOGIES, INC. 2009-09-24 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 (3 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-20130131054-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A RAPGEF4 672/4885ALDH1A1 1557/4885
US-20130203746-A1 TETRACYCLIC COMPOUNDS HTR2C, HTR3D, HTR5A RAPGEF4 672/4885ALDH1A1 1557/4885
US-20090239854-A1 Tetracyclic compounds HTR2C, HTR3D, HTR5A RAPGEF4 672/4885ALDH1A1 1557/4885

“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.