SCHEMBL4156737

SCHEMBL4156737

N#Cc1ccc(N(Cc2csc(-c3ccccc3)n2)CC(F)(F)F)cc1C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AR P10275 10/20 0.40
PGR P06401 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
TP53 P04637 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.38
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
USP30 Q70CQ3 2/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
OXTR P30559 1/20 0.36
TDP1 Q9NUW8 1/20 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
SCHEMBL4152826 0.91 TP53 (0.43) ARPGRKDM4ETP53LMNA
SCHEMBL4145197 0.86 KDM4E (0.41) ARPGRL3MBTL1KDM4EALDH1A1
SCHEMBL4153754 0.83 AR (0.45) ARPGRL3MBTL1HTT
SCHEMBL4154134 0.83 AR (0.53) ARPGRRXRARXRBRXRG
SCHEMBL4151066 0.81 AR (0.46) ARPGRRXRARXRBRXRG
SCHEMBL4137036 0.78 AR (0.45) ARPGRRXRARXRBRXRG
SCHEMBL4154333 0.77 KDM4E (0.43) ARPGRL3MBTL1KDM4EALDH1A1
SCHEMBL4150659 0.77 AR (0.48) ARPGRL3MBTL1KDM4EALDH1A1
SCHEMBL4146594 0.77 AR (0.47) ARPGR
SCHEMBL4145664 0.76 AR (0.46) ARPGRRXRARXRBRXRG

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-20090170907-A1 Chemical Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-07-02 US claimed
US-20090170907-A1 Chemical Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-07-02 US disclosed
US-20090170907-A1 Chemical Compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-07-02 US disclosed
EP-1888512-A2 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2008-02-20 EP disclosed
WO-2006133216-A2 4-SUBSTITUTED ARYLAMINE DERIVATIVES AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS SMITHKLINE BEECHAM CORPORATION (US) 2006-12-14 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-20090170907-A1 Chemical Compounds NR3C2, NR5A1, NR3C1 AR 4/4885PGR 27/4885L3MBTL1 4755/4885

“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.