SCHEMBL1004385

SCHEMBL1004385

COC(=O)c1cccc2oc(Nc3ccncc3)nc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 2/20 0.50
PKN1 Q16512 1/20 0.47
PKN2 Q16513 1/20 0.47
PIM1 P11309 1/20 0.43
PIM2 Q9P1W9 1/20 0.43
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
HTR3A P46098 2/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
GAA P10253 2/20 0.39
JAK2 O60674 1/20 0.39
ATM Q13315 1/20 0.39
ABCB1 P08183 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
AURKA O14965 1/20 0.38
CYP26A1 O43174 1/20 0.38

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
SCHEMBL1003521 0.90 TOP2A (0.58) TOP2APIM1PIM2KMT2AMEN1
SCHEMBL1007687 0.86 TOP2A (0.49) TOP2AKMT2AMEN1MAPTKDM4E
SCHEMBL1003659 0.86 NPC1 (0.43) TOP2APIM1PIM2KMT2AMEN1
SCHEMBL1005701 0.81 TOP2A (0.56) TOP2APKN1PKN2KMT2AHTR3A
SCHEMBL1006335 0.78 TOP2A (0.51) TOP2AKMT2AMEN1MAPTALOX15
SCHEMBL1005317 0.78 HTR3A (0.54) TOP2APKN1PKN2KMT2AHTR3A
SCHEMBL1004337 0.77 TOP2A (0.57) TOP2APKN1PKN2KMT2AMEN1
SCHEMBL1005764 0.77 ALDH1A1 (0.52) TOP2AKMT2AMEN1HTR3AMAPT
SCHEMBL1005268 0.76 NPC1 (0.54) TOP2AKMT2AMEN1HTR3AMAPT
SCHEMBL1398896 0.76 TOP2A (0.59) TOP2APKN1PKN2KMT2AMAPT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101528225-B 2-aminobenzoxazole carboxamides as 5HT3 modulators ALBANY MOLECULAR RES INC 2013-07-17 CN disclosed
US-7863271-B2 2-aminobenzoxazole carboxamides as 5HT3 modulators ALBANY MOLECULAR RESEARCH, INC. (US) 2011-01-04 US disclosed
CN-101528225-A 2-aminobenzoxazole carboxamides as 5HT3 modulators AMR TECHNOLOGY INC (US) 2009-09-09 CN disclosed
EP-2061460-A2 2-AMINOBENZOXAZOLE CARBOXAMIDES AS 5HT3 MODULATORS Albany Molecular Research, Inc. (US) 2009-05-27 EP disclosed
US-20080255114-A1 2-AMINOBENZOXAZOLE CARBOXAMIDES AS 5HT3 MODULATORS AMR TECHNOLOGY, INC. (US) 2008-10-16 US disclosed
WO-2008019372-A2 2-AMINOBENZOXAZOLE CARBOXAMIDES AS 5HT3 MODULATORS ALBANY MOLECULAR RESEARCH, INC. (US) 2008-02-14 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-20080255114-A1 2-AMINOBENZOXAZOLE CARBOXAMIDES AS 5HT3 MODULATORS HTR3E, HTR3C, HTR3A TOP2A 323/4885PKN1 2381/4885PKN2 1085/4885

“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.