SCHEMBL20021936

SCHEMBL20021936

CCCOc1ccc(NC(=O)OC(C)(C)C)cc1-c1ccc(F)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BCL9 O00512 7/20 0.53
CTNNB1 P35222 7/20 0.53
MAPT P10636 1/20 0.45
HSD17B10 Q99714 1/20 0.45
PDE5A O76074 3/20 0.43
FAAH O00519 2/20 0.43
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
CYP17A1 P05093 1/20 0.41
MMP8 P22894 4/20 0.41
MMP3 P08254 2/20 0.41
SREBF2 Q12772 1/20 0.41

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
SCHEMBL18165181 0.90 BCL9 (0.49) BCL9CTNNB1FAAH
SCHEMBL20021934 0.84 BCL9 (0.55) BCL9CTNNB1MAPTHSD17B10PDE5A
SCHEMBL20025818 0.84 BCL9 (0.48) BCL9CTNNB1
SCHEMBL20021931 0.81 MGLL (0.60) BCL9CTNNB1MAPT
SCHEMBL18165108 0.80 CA12 (0.48) CYP17A1MMP8MMP3
SCHEMBL18165102 0.79 MGLL (0.52) BCL9CTNNB1MAPT
SCHEMBL20724159 0.77 MAPT (0.52) MAPTHSD17B10FAAHCYP17A1SREBF2
SCHEMBL20021941 0.77 CTNNB1 (0.86) BCL9CTNNB1
SCHEMBL24875985 0.76 MMP8 (0.47) CYP17A1MMP8MMP3
SCHEMBL20021940 0.75 CTNNB1 (0.90) BCL9CTNNB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180092866-A1 SUBSTITUTED N-([1,1'-BIPHENYL]-3-YL)-[1,1'-BIPHENYL]-3-CARBOXAMIDE ANALOGS AS INHIBITORS FOR BETA-CATENIN/B-CELL LYMPHOMA 9 INTERACTIONS THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE ARMY 2018-04-05 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 (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-20180092866-A1 SUBSTITUTED N-([1,1'-BIPHENYL]-3-YL)-[1,1'-BIPHENYL]-3-CARBOXAMIDE ANALOGS AS INHIBITORS FOR BETA-CATENIN/B-CELL LYMPHOMA 9 INTERACTIONS BCL9, BCL9L, BCL3 BCL9 1/4885CTNNB1 4/4885MAPT 3509/4885

“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.