SCHEMBL20021957

SCHEMBL20021957

Nc1cnc(OC2CCCC2)c(-c2ccc(F)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 8/20 0.47
FEN1 P39748 8/20 0.47
CNR1 P21554 4/20 0.43
BCL9 O00512 7/20 0.40
CTNNB1 P35222 7/20 0.40
BTK Q06187 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
SCHEMBL2114580 0.84 CNR1 (0.54) ALOX5APFEN1CNR1BTK
SCHEMBL20021961 0.80 CNR1 (0.54) CNR1BCL9CTNNB1
SCHEMBL18152353 0.78 BCL9 (0.43) BCL9CTNNB1
SCHEMBL18152351 0.78 BCL9 (0.43) BCL9CTNNB1
SCHEMBL20021959 0.76 BCL9 (0.40) ALOX5APFEN1BCL9CTNNB1
SCHEMBL23611975 0.75 ALOX5AP (0.42) ALOX5APFEN1
SCHEMBL18165166 0.74 PIK3CD (0.50)
SCHEMBL623436 0.72 BTK (0.50) ALOX5APFEN1BTK
SCHEMBL29476657 0.72 BTK (0.50) ALOX5APFEN1BTK
SCHEMBL29973001 0.71 MAP4K4 (0.56)

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 ALOX5AP 3604/4885FEN1 3180/4885CNR1 1005/4885

“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.