SCHEMBL1563869

SCHEMBL1563869

Nc1ncc(Br)cc1NC(=O)CN1CCOCC1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.62
▸ ALDH1A1 P00352 9/20 0.53
▸ HTT P42858 2/20 0.53
▸ GAA P10253 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ KDM4E B2RXH2 2/20 0.51
▸ MAPT P10636 2/20 0.48
▸ CLK1 P49759 1/20 0.48
▸ EGFR P00533 1/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ L3MBTL1 Q9Y468 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
SCHEMBL14995363 0.77 TSHR (1.00) TSHRALDH1A1HTTMAPTCLK1
SCHEMBL14905758 0.76 LMNA (0.46) KDM4EEGFRLMNAMEN1KMT2A
SCHEMBL16098263 0.75 ALDH1A1 (0.57) TSHRALDH1A1HTTGAANPSR1
SCHEMBL16913890 0.74 HDAC4 (0.48) HTTGAAKDM4EMAPTLMNA
SCHEMBL27006800 0.72 TSHR (0.69) TSHRALDH1A1HTTMAPTCLK1
SCHEMBL20703988 0.72 RAB9A (0.46) ALDH1A1GAAMAPTLMNAMEN1
SCHEMBL15986711 0.72 TSHR (0.72) TSHRALDH1A1KDM4EEGFRSMN1; SMN2
SCHEMBL30648834 0.72 TSHR (0.72) TSHRALDH1A1KDM4EEGFRSMN1; SMN2
SCHEMBL1251926 0.71 LMNA (0.53) LMNA
SCHEMBL20266375 0.71 HPGD (0.48) TSHRALDH1A1HTTGAANPSR1

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
US-8785438-B2 Imidazopyridin-2-one derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2014-07-22 — — US disclosed
EP-2308877-B1 IMIDAZOPYRIDIN-2-ONE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2014-01-22 — — EP disclosed
US-20130338156-A1 IMIDAZOPYRIDIN-2-ONE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-12-19 — — US disclosed
US-8436012-B2 Imidazopyridin-2-one derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-05-07 — — US disclosed
EP-2308877-A1 IMIDAZOPYRIDIN-2-ON DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2011-04-13 — — EP disclosed
US-20110082138-A1 IMIDAZOPYRIDIN-2-ONE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-04-07 — — 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-20110082138-A1 IMIDAZOPYRIDIN-2-ONE DERIVATIVES MTOR, MAPKAP1, RICTOR TSHR 3070/4885ALDH1A1 2312/4885HTT 1471/4885
US-20130338156-A1 IMIDAZOPYRIDIN-2-ONE DERIVATIVES MTOR, MAPKAP1, RICTOR TSHR 3070/4885ALDH1A1 2312/4885HTT 1471/4885

“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.

Send feedback