SCHEMBL406716

SCHEMBL406716

Oc1cccc(-n2cccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.56
ALDH1A1 P00352 2/20 0.50
HSD17B10 Q99714 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
CYP3A4 P08684 2/20 0.50
CA12 O43570 1/20 0.50
CA2 P00918 1/20 0.50
LMNA P02545 1/20 0.50
CA5A P35218 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
CA5B Q9Y2D0 1/20 0.50
ESR1 P03372 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
AOC2 O75106 2/20 0.47
KDM4E B2RXH2 2/20 0.46
POLB P06746 2/20 0.46
HPGD P15428 1/20 0.46

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
SCHEMBL20319187 0.82 MAPT (0.68) MAPTALDH1A1HSD17B10NPC1RAB9A
SCHEMBL30797813 0.77 FGFR1 (0.47) ALDH1A1HSD17B10NPC1RAB9ACYP3A4
SCHEMBL859964 0.77 FGFR1 (0.47) ALDH1A1HSD17B10NPC1RAB9ACYP3A4
SCHEMBL3071130 0.76 IDO1 (0.64) MAPTCYP3A4LMNAMEN1KMT2A
SCHEMBL29483362 0.76 IDO1 (0.64) MAPTCYP3A4LMNAMEN1KMT2A
SCHEMBL18050030 0.73 FGFR1 (0.47) ALDH1A1HSD17B10NPC1RAB9ACYP3A4
SCHEMBL599252 0.72 VHL (0.56) MAPTALDH1A1HSD17B10NPC1RAB9A
Iodide SCHEMBL20656688 0.72 MEN1 (0.38) ALDH1A1HSD17B10NPC1RAB9ACYP3A4
SCHEMBL405705 0.72 TUBB4A (0.58) CA12CA2CA9TUBB4ATUBB
SCHEMBL632230 0.71 MAPT (1.00) MAPTALDH1A1HSD17B10CYP3A4CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3068758-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE The Wistar Institute Of Anatomy And Biology (US) 2016-09-21 EP disclosed
WO-2015073864-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE THE WISAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2015-05-21 WO disclosed
CN-101180264-B Benzoic acid ester compounds, compositions, uses and methods related thereto FERRER INT 2013-03-27 CN disclosed
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
EP-1555267-B1 2,3-DIHYDRO-6-NITROIMIDAZO[2,1-b]OXAZOLES OTSUKA PHARMA CO LTD (JP) 2013-01-16 EP disclosed
EP-2408743-A1 CARBAMATE DERIVATIVES IN PARTICULAR FOR THE TREATMENT OF NEUROLOGICAL DISORDERS SIGMA-TAU Industrie Farmaceutiche Riunite S.p.A. (IT) 2012-01-25 EP disclosed
CN-101180264-A Benzoic acid ester compounds, compositions, uses and methods related thereto FERRER INT (ES) 2008-05-14 CN disclosed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US disclosed
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-05-04 US disclosed
CN-1705670-A 2, 3-dihydro-6-nitroimidazo [2, 1-b ] oxazole compounds OTSUKA PHARMA CO LTD (JP) 2005-12-07 CN disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP 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-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 MAPT 4117/4885ALDH1A1 355/4885HSD17B10 467/4885

“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.