SCHEMBL756497

SCHEMBL756497

Cn1ccnc1-c1oc2ccc(OCc3ccc(F)cc3)cc2c(=O)c1O

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
HTT P42858 1/20 0.51
ANO1 Q5XXA6 5/20 0.51
MAOB P27338 9/20 0.47
ACHE P22303 2/20 0.47
MAOA P21397 4/20 0.45
CYP19A1 P11511 1/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
PKM P14618 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL12207267 0.81 LMNA (0.68) LMNAHTTANO1MAOBACHE
SCHEMBL765549 0.80 ANO1 (0.52) LMNAHTTANO1MAOBACHE
SCHEMBL754620 0.78 ANO1 (0.48) LMNAHTTANO1MAOBACHE
SCHEMBL756334 0.75 HTT (0.57) LMNAHTTANO1MAOBACHE
SCHEMBL751538 0.74 LMNA (0.62) LMNAHTTANO1MAOBACHE
SCHEMBL17922056 0.70 MAPT (0.47) ANO1MAOBACHEMAOATP53
SCHEMBL3434393 0.70 MAOB (0.38) LMNAHTTANO1MAOBACHE
SCHEMBL27326001 0.69 CSNK2A2 (0.59) ANO1ACHEMAOACYP19A1TP53
SCHEMBL3221505 0.69 LMNA (0.60) LMNAHTTANO1MAOBACHE
SCHEMBL24470810 0.68 LMNA (1.00) LMNAHTTANO1L3MBTL1

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-2266958-B1 Antiviral agent SHIONOGI & CO (JP) 2017-03-15 EP disclosed
US-20170066754-A1 ANTIVIRAL AGENT SHIONOGI & CO., LTD. (JP) 2017-03-09 US disclosed
US-9572813-B2 Antiviral agent SHIONOGI & CO., LTD. (JP) 2017-02-21 US disclosed
EP-3042894-A1 ANTIVIRAL AGENT SHIONOGI & CO., LTD. (JP) 2016-07-13 EP disclosed
US-20150202208-A1 ANTIVIRAL AGENT SHIONOGI & CO., LTD. (JP) 2015-07-23 US disclosed
EP-1422218-B1 ANTIVIRAL AGENT SHIONOGI & CO (JP) 2012-03-21 EP disclosed
EP-2181985-B1 Antiviral Agent SHIONOGI & CO (JP) 2011-10-26 EP disclosed
EP-2266958-A1 Antiviral agent SHIONOGI & CO., LTD. (JP) 2010-12-29 EP disclosed
EP-2181985-A1 Antiviral Agent SHIONOGI & CO., LTD. (JP) 2010-05-05 EP disclosed
US-20040229909-A1 Antiviral agent SHIONOGI & CO., LTD. (JP) 2004-11-18 US disclosed
EP-1422218-A1 ANTIVIRAL AGENT SHIONOGI & CO., LTD. (JP) 2004-05-26 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 (3 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-20040229909-A1 Antiviral agent ZC3HAV1, ZC3HAV1L, DUT LMNA 2825/4885HTT 4561/4885ANO1 4534/4885
US-20150202208-A1 ANTIVIRAL AGENT ZC3HAV1, ZC3HAV1L, CCNI LMNA 2945/4885HTT 4541/4885ANO1 4705/4885
US-20170066754-A1 ANTIVIRAL AGENT ZC3HAV1, ZC3HAV1L, CCNI LMNA 2945/4885HTT 4541/4885ANO1 4705/4885

“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.