SCHEMBL21392903

SCHEMBL21392903

C=CC(=O)Nc1ccc(Oc2cccc(N3CCOCC3)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 2/20 0.59
JAK3 P52333 8/20 0.55
BTK Q06187 3/20 0.55
JAK2 O60674 6/20 0.52
JAK1 P23458 6/20 0.52
NTRK1 P04629 1/20 0.51
EGFR P00533 4/20 0.51
TYK2 P29597 2/20 0.50
MAPT P10636 2/20 0.50
KDM4E B2RXH2 1/20 0.50
BLK P51451 1/20 0.49
ITK Q08881 1/20 0.49
MET P08581 1/20 0.49
RAF1 P04049 1/20 0.49
F13A1 P00488 1/20 0.49
TGM1 P22735 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49

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
SCHEMBL21392906 0.86 TGM2 (0.59) TGM2JAK3BTKJAK2JAK1
SCHEMBL16628031 0.78 RAF1 (0.61) METRAF1
SCHEMBL21295393 0.77 MAPT (0.64) NTRK1MAPTKDM4ERAF1ALDH1A1
SCHEMBL9017578 0.76 TGM2 (1.00) TGM2EGFRMAPTF13A1TGM1
SCHEMBL8151744 0.75 MTNR1B (0.74) TGM2RAF1ALDH1A1
SCHEMBL21392902 0.75 TGM2 (0.71) TGM2BTKEGFRBLKALDH1A1
SCHEMBL14341775 0.75 TGM2 (0.86) TGM2EGFRMAPTF13A1TGM1
SCHEMBL23421241 0.75 BTK (0.68) JAK3BTKJAK2JAK1EGFR
SCHEMBL6014834 0.75 RAB9A (0.67) NTRK1MAPTKDM4ERAF1ALDH1A1
SCHEMBL23243736 0.75 CTSC (0.83) JAK3BTKJAK2JAK1EGFR

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-20190290778-A1 METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY FRONTIER MEDICINES CORPORATION 2019-09-26 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-20190290778-A1 METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY ATG7, BECN1, SQSTM1 TGM2 2225/4885JAK3 4008/4885BTK 4180/4885

“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.