SCHEMBL7345369

SCHEMBL7345369

CCOC(=O)C(Cc1cccnc1)C(=O)OCC

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.52
FDPS P14324 1/20 0.50
PKM P14618 2/20 0.48
KMT2A Q03164 2/20 0.48
NAPRT Q6XQN6 1/20 0.47
TBXAS1 P24557 2/20 0.47
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
ALDH1A1 P00352 1/20 0.45
KDM4E B2RXH2 1/20 0.45
TRPM8 Q7Z2W7 1/20 0.45
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45
CYP3A4 P08684 1/20 0.44

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
SCHEMBL3949678 0.94 MMP8 (0.54) MMP8FDPSPKMKMT2ANAPRT
SCHEMBL2429056 0.93 MMP8 (0.49) MMP8FDPSPKMKMT2ANAPRT
SCHEMBL18039180 0.86 CYP1A2 (0.50) FDPSPKMKMT2ANAPRTTBXAS1
SCHEMBL2420345 0.86 TBXAS1 (0.56) FDPSPKMKMT2ANAPRTTBXAS1
SCHEMBL30178281 0.86 TBXAS1 (0.56) FDPSPKMKMT2ANAPRTTBXAS1
SCHEMBL2370955 0.85 ALDH1A1 (0.48) FDPSPKMKMT2ANAPRTTBXAS1
SCHEMBL30178278 0.85 FDPS (0.48) FDPSPKMKMT2ANAPRTTBXAS1
SCHEMBL20543866 0.85 FDPS (0.48) FDPSPKMKMT2ANAPRTTBXAS1
SCHEMBL21947585 0.85 FDPS (0.48) FDPSPKMKMT2ANAPRTTBXAS1
SCHEMBL8633006 0.85 TDP1 (0.47) PKMKMT2ANAPRTTBXAS1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9938258-B2 Substituted 2,3-dihydrobenzofuranyl compounds and uses thereof Karyopharm Therapeutics Inc. (US) 2018-04-10 US disclosed
US-9938258-B2 Substituted 2,3-dihydrobenzofuranyl compounds and uses thereof Karyopharm Therapeutics Inc. (US) 2018-04-10 US disclosed
US-9938258-B2 Substituted 2,3-dihydrobenzofuranyl compounds and uses thereof Karyopharm Therapeutics Inc. (US) 2018-04-10 US disclosed
US-20160221994-A1 Substituted 2,3-Dihydrobenzofuranyl Compounds And Uses Thereof Karyopharm Therapeutics Inc. 2016-08-04 US disclosed
US-20160221994-A1 Substituted 2,3-Dihydrobenzofuranyl Compounds And Uses Thereof Karyopharm Therapeutics Inc. 2016-08-04 US disclosed
US-20160221994-A1 Substituted 2,3-Dihydrobenzofuranyl Compounds And Uses Thereof Karyopharm Therapeutics Inc. 2016-08-04 US disclosed
EP-2925750-A1 SUBSTITUTED 2,3-DIHYDROBENZOFURANYL COMPOUNDS AND USES THEREOF Karyopharm Therapeutics, Inc. (US) 2015-10-07 EP disclosed
WO-2014085607-A1 SUBSTITUTED 2,3-DIHYDROBENZOFURANYL COMPOUNDS AND USES THEREOF Karyopharm Therapeutics Inc. (US) 2014-06-05 WO disclosed
WO-2014085607-A1 SUBSTITUTED 2,3-DIHYDROBENZOFURANYL COMPOUNDS AND USES THEREOF Karyopharm Therapeutics Inc. (US) 2014-06-05 WO disclosed
EP-0636621-B1 Beta-mercapto-propanamide derivatives useful in the treatment of cardiovascular diseases ZAMBON SPA (IT) 1997-03-12 EP disclosed
US-5506259-A β-mercapto-propanamide derivatives useful in the treatment of cardiovascular diseases ZAMBON GROUP S.P.A. (IT) 1996-04-09 US disclosed
EP-0636621-A1 Beta-mercapto-propanamide derivatives useful in the treatment of cardiovascular diseases ZAMBON GROUP S.p.A. (IT) 1995-02-01 EP disclosed
CN-1072413-A Amino acid derivative HOFFMANN LA ROCHE (CH) 1993-05-26 CN 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-20160221994-A1 Substituted 2,3-Dihydrobenzofuranyl Compounds And Uses Thereof BCL6, MALT1, BCL3 MMP8 4635/4885FDPS 20/4885PKM 1905/4885

“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.