SCHEMBL6090580

SCHEMBL6090580

Cc1cccc(Cl)c1C(=O)Cc1ccc(C(=O)O)cc1-c1cccs1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.38
AR P10275 1/20 0.37
SRPK1 Q96SB4 1/20 0.37
RPS6KB2 Q9UBS0 1/20 0.37
RORC P51449 7/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
CYP2C9 P11712 1/20 0.35
PTGES O14684 1/20 0.35
MAPT P10636 3/20 0.34
THRB P10828 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
TP53 P04637 1/20 0.34
ACLY P53396 1/20 0.34
CSF1R P07333 1/20 0.34
KIT P10721 1/20 0.34
KMT2A Q03164 1/20 0.34
SLC22A12 Q96S37 1/20 0.34

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
SCHEMBL6092865 0.92 AR (0.40) POLBARSRPK1RPS6KB2L3MBTL1
SCHEMBL6093104 0.89 MAPT (0.43) POLBL3MBTL1MAPTTHRBTDP1
SCHEMBL6091614 0.81 MAPT (0.44) POLBL3MBTL1MAPTTHRBTDP1
SCHEMBL6091524 0.81 TNFRSF1A (0.44) ARSRPK1RPS6KB2L3MBTL1MAPT
SCHEMBL6091074 0.78 AR (0.38) POLBARSRPK1RPS6KB2RORC
SCHEMBL8379240 0.78 SRPK1 (0.47) POLBARSRPK1RPS6KB2PTGES
SCHEMBL6110232 0.77 TNFRSF1A (0.44) SRPK1RPS6KB2
SCHEMBL27142785 0.73 SRPK1 (0.50) POLBARSRPK1RPS6KB2L3MBTL1
SCHEMBL6092305 0.71 AR (0.42) ARSRPK1RPS6KB2L3MBTL1MAPT
SCHEMBL6093222 0.71 MAPT (0.48) L3MBTL1MAPTTHRBTDP1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060063828-A1 1,2-Bis-(substituted-phenyl)-2-propen-1-ones and pharmaceutical compositions thereof ATHEROGENICS, INC. 2006-03-23 US disclosed
WO-2006004903-A2 1,2-BIS-(SUBSTITUTED-PHENYL)-2-PROPEN-1-ONES AND PHARMACEUTICAL COMPOSITIONS THEREOF ATHEROGENICS, INC. (US) 2006-01-12 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-20060063828-A1 1,2-Bis-(substituted-phenyl)-2-propen-1-ones and pharmaceutical compositions thereof ABCB11, CEL, CYP46A1 POLB 2647/4885AR 2130/4885SRPK1 3318/4885

“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.