SCHEMBL20021935

SCHEMBL20021935

CCCOc1ccc(C(=O)OC)cc1-c1ccc(F)c(F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL9 O00512 8/20 0.55
CTNNB1 P35222 8/20 0.55
PDE4D Q08499 1/20 0.46
NLRP3 Q96P20 1/20 0.45
TTR P02766 1/20 0.43
ERN1 O75460 1/20 0.43
BRD4 O60885 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RORC P51449 1/20 0.40
PPARD Q03181 1/20 0.40
AR P10275 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAOA P21397 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
SCHEMBL20021919 0.88 BCL9 (0.54) BCL9CTNNB1PDE4DNLRP3BRD4
SCHEMBL20021939 0.88 BCL9 (0.55) BCL9CTNNB1PPARD
SCHEMBL18152331 0.83 BCL9 (0.49) BCL9CTNNB1PDE4DHDAC1HDAC8
SCHEMBL18152455 0.82 BCL9 (0.48) BCL9CTNNB1TTRERN1BRD4
SCHEMBL15295180 0.82 PDE4D (0.53) PDE4DNLRP3TTRCYP1A2CYP3A4
SCHEMBL13535957 0.82 TTR (0.59) PDE4DNLRP3TTRCYP1A2CYP3A4
SCHEMBL20021941 0.80 CTNNB1 (0.86) BCL9CTNNB1
SCHEMBL18165180 0.79 RARB (0.53) BCL9CTNNB1HDAC3HDAC1HDAC2
SCHEMBL20021940 0.79 CTNNB1 (0.90) BCL9CTNNB1
SCHEMBL18165178 0.78 RARB (0.59) BCL9CTNNB1PPARD

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 4/4885PDE4D 3631/4885

“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.