SCHEMBL2544032

SCHEMBL2544032

CC(O)c1ccc2c(c1)oc(=O)n2Cc1cccc(N(CCCN2CCN(C)CC2)C(=O)O)c1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.40
MIF P14174 2/20 0.40
TNIK Q9UKE5 1/20 0.38
TSHR P16473 1/20 0.37
TP53 P04637 1/20 0.37
NPC1 O15118 1/20 0.37

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
SCHEMBL2544331 0.94 SIGMAR1 (0.40) SIGMAR1MIF
SCHEMBL2544025 0.89 MIF (0.53) SIGMAR1MIFTP53
SCHEMBL2542427 0.88 SIGMAR1 (0.46) SIGMAR1MIFTP53
SCHEMBL2546966 0.88 TP53 (0.48) MIFTP53
SCHEMBL2544322 0.87 SLC6A2 (0.49) SIGMAR1MIF
SCHEMBL2543339 0.86 TNIK (0.49) MIFTNIKTSHR
SCHEMBL2540868 0.85 IDO1 (0.40) SIGMAR1MIF
SCHEMBL2540918 0.84 POLB (0.54) SIGMAR1MIFTSHRTP53
SCHEMBL2542689 0.83 SIGMAR1 (0.54) SIGMAR1TP53
SCHEMBL2542515 0.82 ALDH1A1 (0.50) MIFTP53

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-20110263596-A1 2-OXO-3-BENZYLBENZOXAZOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS AS MET KINASE INHIBITORS FOR THE TREATMENT OF TUMOURS SCHADT OLIVER 2011-10-27 US claimed
US-20110263596-A1 2-OXO-3-BENZYLBENZOXAZOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS AS MET KINASE INHIBITORS FOR THE TREATMENT OF TUMOURS SCHADT OLIVER 2011-10-27 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-20110263596-A1 2-OXO-3-BENZYLBENZOXAZOL-2-ONE DERIVATIVES AND RELATED COMPOUNDS AS MET KINASE INHIBITORS FOR THE TREATMENT OF TUMOURS MET, RET, ERBB2 SIGMAR1 3648/4885MIF 2143/4885TNIK 389/4885

“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.