SCHEMBL19404232

SCHEMBL19404232

NCCOc1ccc(C(N)=O)cc1-c1ccc(F)cc1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BCL9 O00512 9/20 0.69
CTNNB1 P35222 9/20 0.69
SYK P43405 1/20 0.47
AR P10275 1/20 0.45
HTR2A P28223 1/20 0.44
PTGS1 P23219 1/20 0.44
TP53 P04637 1/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
MAOB P27338 1/20 0.43
PARP10 Q53GL7 1/20 0.43
TOP2A P11388 1/20 0.41
RORC P51449 1/20 0.40
GRM2 Q14416 1/20 0.40
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 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
Hydrochloric Acid SCHEMBL23456354 0.99 BCL9 (0.71) BCL9CTNNB1SYKARHTR2A
SCHEMBL20021929 0.88 BCL9 (0.55) BCL9CTNNB1SYKARPTGS1
SCHEMBL18165153 0.83 BCL9 (0.98) BCL9CTNNB1HTR2A
SCHEMBL18165177 0.78 BCL9 (0.48) BCL9CTNNB1SYKPTGS1RAB9A
SCHEMBL20021879 0.78 BCL9 (0.88) BCL9CTNNB1HTR2A
SCHEMBL18165149 0.78 CTNNB1 (0.98) BCL9CTNNB1
SCHEMBL18165096 0.78 BCL9 (0.98) BCL9CTNNB1HTR2A
SCHEMBL6305137 0.77 MAPK1 (0.45) BCL9CTNNB1ARMAPK1RAB9A
SCHEMBL18152465 0.76 BCL9 (0.51) BCL9CTNNB1SYKHTR2A
SCHEMBL18165097 0.76 CTNNB1 (0.98) 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 2 patents. 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
WO-2017165839-A1 METHODS AND COMPOSITION OF 4-SUBSTITUTED BENZOYLPIPERAZINE-1-SUBSTITUTED CARBONYLS AS BETA-CATENIN/B-CELL LYMPHOMA 9 INHIBITORS UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2017-09-28 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-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 4/4885SYK 2252/4885

“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.