SCHEMBL20149549

SCHEMBL20149549

Cc1ccc2ccccc2c1CN1CCCCC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.68
CRHR2 Q13324 1/20 0.68
KDM4E B2RXH2 8/20 0.65
MAPT P10636 7/20 0.65
ALDH1A1 P00352 7/20 0.65
GAA P10253 2/20 0.65
CFB P00751 1/20 0.51
KMT2A Q03164 4/20 0.50
ERN1 O75460 1/20 0.50
MEN1 O00255 1/20 0.50
HTT P42858 3/20 0.47
HPGD P15428 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
CHRNA7 P36544 1/20 0.47
MAPK1 P28482 2/20 0.44
HSD17B10 Q99714 1/20 0.44
LMNA P02545 2/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL4753312 0.84 SIGMAR1 (0.55) CRHBPCRHR2KDM4EMAPTALDH1A1
SCHEMBL13700903 0.81 CRHBP (1.00) CRHBPCRHR2KDM4EMAPTALDH1A1
SCHEMBL30294879 0.81 CRHBP (1.00) CRHBPCRHR2KDM4EMAPTALDH1A1
SCHEMBL807228 0.80 MEN1 (0.77) CRHBPCRHR2KDM4EMAPTALDH1A1
SCHEMBL31090415 0.80 CRHBP (0.66) CRHBPCRHR2KDM4EMAPTALDH1A1
SCHEMBL18717316 0.79 CRHBP (0.54) CRHBPCRHR2KDM4EMAPTALDH1A1
SCHEMBL18955751 0.79 MAPT (1.00) CRHBPCRHR2KDM4EMAPTALDH1A1
SCHEMBL29432837 0.79 MAPT (1.00) CRHBPCRHR2KDM4EMAPTALDH1A1
SCHEMBL6797257 0.78 KMT2A (0.79) CRHBPCRHR2KDM4EMAPTALDH1A1
SCHEMBL806920 0.77 CFB (0.53) CRHBPCRHR2KDM4EALDH1A1CFB

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-10273246-B2 Methods and compositions of substituted 5H-[1,2,5] oxadiazolo [3′,4′:5,6] pyrazino[2,3-B] indole analogs as inhibitors of β-catenin/T-cell factor protein-protein interactions UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2019-04-30 US disclosed
US-20180134729-A1 METHODS AND COMPOSITIONS OF SUBSTITUTED 5H-[1,2,5] OXADIAZOLO [3',4':5,6] PYRAZINO[2,3-B] INDOLE ANALOGS AS INHIBITORS OF BETA-CATENIN/T-CELL FACTOR PROTEIN-PROTEIN INTERACTIONS UNIVERSITY OF UTAH 2018-05-17 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 (2 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-20180134729-A1 METHODS AND COMPOSITIONS OF SUBSTITUTED 5H-[1,2,5] OXADIAZOLO [3',4':5,6] PYRAZINO[2,3-B] INDOLE ANALOGS AS INHIBITORS OF BETA-CATENIN/T-CELL FACTOR PROTEIN-PROTEIN INTERACTIONS CTNNB1, CTNNBL1, WNT3A CRHBP 1290/4885CRHR2 3935/4885KDM4E 2497/4885
US-10273246-B2 Methods and compositions of substituted 5H-[1,2,5] oxadiazolo [3′,4′:5,6] pyrazino[2,3-B] indole analogs as inhibitors of β-catenin/T-cell factor protein-protein interactions CTNNB1, CTNNBL1, WNT3A CRHBP 1295/4885CRHR2 3916/4885KDM4E 2264/4885

“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.