SCHEMBL20021960

SCHEMBL20021960

O=C(Nc1cnc(OC2CCCC2)c(-c2ccc(F)cc2)c1)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.53
BCL9 O00512 4/20 0.47
CTNNB1 P35222 4/20 0.47
ROCK2 O75116 2/20 0.44
RORC P51449 2/20 0.43
BCHE P06276 1/20 0.43
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
POLB P06746 1/20 0.42
CNR1 P21554 1/20 0.42

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
SCHEMBL18152476 0.82 RORC (0.49) MGLLRORC
SCHEMBL18152479 0.80 MGLL (0.44) MGLLBCL9CTNNB1RORCBCHE
SCHEMBL18152474 0.80 MGLL (0.44) MGLLBCL9CTNNB1RORCBCHE
SCHEMBL20021944 0.77 MGLL (0.55) MGLLROCK2POLB
SCHEMBL19510609 0.77 FFAR4 (0.54) POLB
SCHEMBL20021961 0.75 CNR1 (0.54) BCL9CTNNB1CNR1
SCHEMBL21062556 0.72 MGLL (0.52) MGLLBCL9CTNNB1BCHE
SCHEMBL21062557 0.72 MGLL (0.52) MGLLBCL9CTNNB1BCHE
SCHEMBL27815058 0.71 MGLL (0.71) MGLLROCK2BCHEPOLB
SCHEMBL26110269 0.71 MGLL (0.48) MGLLBCHE

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 MGLL 3288/4885BCL9 1/4885CTNNB1 4/4885

“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.