SCHEMBL1920886

SCHEMBL1920886

C[C@@](N)(CC(=O)O)c1ccc(Cl)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.61
KMT2A Q03164 5/20 0.45
MEN1 O00255 4/20 0.45
CYP2C19 P33261 4/20 0.44
HIF1A Q16665 1/20 0.44
GRIN2D O15399 1/20 0.44
GRIN3B O60391 1/20 0.44
GRIN1 Q05586 1/20 0.44
GRIN2A Q12879 1/20 0.44
GRIN2B Q13224 1/20 0.44
GRIN2C Q14957 1/20 0.44
GRIN3A Q8TCU5 1/20 0.44
POLB P06746 1/20 0.43
LMNA P02545 3/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC6A2 P23975 1/20 0.41
HTR2A P28223 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
SCHEMBL17047210 1.00 MIF (0.61) MIFKMT2AMEN1CYP2C19HIF1A
SCHEMBL831691 1.00 MIF (0.61) MIFKMT2AMEN1CYP2C19HIF1A
SCHEMBL1444112 0.83 CYP2C19 (0.46) MIFKMT2ACYP2C19HIF1ALMNA
SCHEMBL2300536 0.82 CYP2C19 (0.64) KMT2ACYP2C19HIF1AMAPTCYP1A2
SCHEMBL167044 0.82 CYP2C19 (0.64) KMT2ACYP2C19HIF1AMAPTCYP1A2
SCHEMBL2295046 0.82 CYP2C19 (0.64) KMT2ACYP2C19HIF1AMAPTCYP1A2
SCHEMBL1585458 0.81 CYP2C19 (0.44) MIFKMT2AMEN1CYP2C19HIF1A
SCHEMBL24020497 0.81 MIF (0.66) MIFKMT2AMEN1CYP2C19HIF1A
SCHEMBL8476286 0.81 CYP2C19 (0.68) MIFKMT2AMEN1CYP2C19HIF1A
SCHEMBL987076 0.81 MIF (0.66) MIFKMT2AMEN1CYP2C19HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10071068-B2 Sustained release oral dosage forms of an R-baclofen prodrug XENOPORT, INC. (US) 2018-09-11 US claimed
EP-2117517-B1 SUSTAINED RELEASE ORAL DOSAGE FORMS OF A PRODRUG OF R-BACLOFEN AND METHODS OF TREATMENT XENOPORT INC (US) 2011-06-01 EP claimed
US-20100255093-A1 SUSTAINED RELEASE ORAL DOSAGE FORMS OF AN R-BACLOFEN PRODRUG XENOPORT, INC. (US) 2010-10-07 US claimed
US-20100137442-A2 Sustained Release Particulate Oral Dosage Forms of (R)-Baclofen and Methods of Treatment XENOPORT, INC. (US) 2010-06-03 US claimed
US-20090197958-A1 Sustained Release Particulate Oral Dosage Forms of (R) Baclofen and Methods of Treatment XENOPORT, INC. (US) 2009-08-06 US claimed
US-20080206332-A1 SUSTAINED RELEASE ORAL DOSAGE FORMS OF A PRODRUG OF R-BACLOFEN AND METHODS OF TREATMENT WILSHIRE PHARMACEUTICALS, INC. 2008-08-28 US claimed
US-10071068-B2 Sustained release oral dosage forms of an R-baclofen prodrug XENOPORT, INC. (US) 2018-09-11 US disclosed
EP-2117517-B1 SUSTAINED RELEASE ORAL DOSAGE FORMS OF A PRODRUG OF R-BACLOFEN AND METHODS OF TREATMENT XENOPORT INC (US) 2011-06-01 EP disclosed
US-20100255093-A1 SUSTAINED RELEASE ORAL DOSAGE FORMS OF AN R-BACLOFEN PRODRUG XENOPORT, INC. (US) 2010-10-07 US disclosed
US-20100137442-A2 Sustained Release Particulate Oral Dosage Forms of (R)-Baclofen and Methods of Treatment XENOPORT, INC. (US) 2010-06-03 US disclosed
US-20090197958-A1 Sustained Release Particulate Oral Dosage Forms of (R) Baclofen and Methods of Treatment XENOPORT, INC. (US) 2009-08-06 US disclosed
US-20080206332-A1 SUSTAINED RELEASE ORAL DOSAGE FORMS OF A PRODRUG OF R-BACLOFEN AND METHODS OF TREATMENT WILSHIRE PHARMACEUTICALS, INC. 2008-08-28 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 (5 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-20100137442-A2 Sustained Release Particulate Oral Dosage Forms of (R)-Baclofen and Methods of Treatment GABBR2, GABBR1, GABRB2 MIF 3910/4885KMT2A 4184/4885MEN1 2287/4885
US-20080206332-A1 SUSTAINED RELEASE ORAL DOSAGE FORMS OF A PRODRUG OF R-BACLOFEN AND METHODS OF TREATMENT GABBR2, GABBR1, GABRB2 MIF 4208/4885KMT2A 3861/4885MEN1 1999/4885
US-20090197958-A1 Sustained Release Particulate Oral Dosage Forms of (R) Baclofen and Methods of Treatment GABBR2, GABBR1, GABRB2 MIF 4029/4885KMT2A 4008/4885MEN1 2074/4885
US-10071068-B2 Sustained release oral dosage forms of an R-baclofen prodrug GABRB2, GABRB3, GABBR2 MIF 4039/4885KMT2A 3441/4885MEN1 2120/4885
US-20100255093-A1 SUSTAINED RELEASE ORAL DOSAGE FORMS OF AN R-BACLOFEN PRODRUG GABRB2, GABRB3, GABBR2 MIF 4039/4885KMT2A 3441/4885MEN1 2120/4885

“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.