SCHEMBL1926470

SCHEMBL1926470

C[C@H](CO)OC(=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2D6 P10635 1/20 0.55
POLB P06746 1/20 0.55
SCN1A P35498 1/20 0.55
SCN2A Q99250 1/20 0.55
SCN3A Q9NY46 1/20 0.55
TSHR P16473 3/20 0.55
TP53 P04637 1/20 0.55
NPC1 O15118 2/20 0.54
PDCD1 Q15116 1/20 0.53
CD274 Q9NZQ7 1/20 0.53
ALDH1A1 P00352 2/20 0.50
HTT P42858 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PRKCA P17252 1/20 0.49
F2 P00734 1/20 0.48
CYP4F2 P78329 1/20 0.46
CYP4A11 Q02928 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
SCHEMBL525077 1.00 LMNA (0.55) LMNACYP1A2CYP2D6POLBSCN1A
SCHEMBL7615892 0.90 CYP4F2 (0.55) LMNACYP1A2CYP2D6POLBSCN1A
SCHEMBL4915922 0.90 PDCD1 (0.70) LMNACYP1A2CYP2D6POLBSCN1A
SCHEMBL17797890 0.88 LMNA (0.49) LMNACYP1A2CYP2D6POLBSCN1A
SCHEMBL855278 0.87 MAPT (0.51) LMNACYP1A2CYP2D6POLBSCN1A
SCHEMBL4336178 0.87 LMNA (0.48) LMNACYP1A2CYP2D6POLBSCN1A
SCHEMBL14690004 0.86 TSHR (0.57) LMNACYP1A2CYP2D6POLBSCN1A
SCHEMBL560828 0.86 TSHR (0.57) LMNACYP1A2CYP2D6POLBSCN1A
SCHEMBL1068955 0.86 TSHR (0.57) LMNACYP1A2CYP2D6POLBSCN1A
SCHEMBL1784136 0.86 TSHR (0.57) LMNACYP1A2CYP2D6POLBSCN1A

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-20190308934-A1 Prodrugs of Chlorokynurenines CEPHALON INC (US) 2019-10-10 US disclosed
US-20120190861-A1 Levodopa Prodrugs, and Compositions and Uses Thereof XENOPORT, INC. (US) 2012-07-26 US disclosed
EP-1751087-B1 LEVODOPA DERIVATIVES, AND COMPOSITIONS AND USES THEREOF XENOPORT INC (US) 2012-06-27 EP disclosed
US-8163958-B2 Levodopa prodrugs, and compositions and uses thereof XENOPORT, INC. (US) 2012-04-24 US disclosed
US-20110201817-A1 LEVODOPA PRODRUGS, AND COMPOSITIONS AND USES THEREOF XENOPORT, INC. (US) 2011-08-18 US disclosed
US-7956212-B2 Levodopa prodrugs, and compositions and uses thereof XENOPORT, INC. (US) 2011-06-07 US disclosed
US-20100197953-A9 LEVODOPA PRODRUGS, AND COMPOSITIONS AND USES THEREOF XENOPORT, INC. (US) 2010-08-05 US disclosed
US-20090137834-A1 LEVODOPA PRODRUGS, AND COMPOSITIONS AND USES THEREOF XENOPORT, INC. (US) 2009-05-28 US disclosed
US-7534813-B2 Levodopa prodrugs, and compositions and uses thereof XENOPORT, INC. (US) 2009-05-19 US disclosed
US-20080132570-A1 Levodopa prodrugs, and compositions and uses thereof XENOPORT, INC. (US) 2008-06-05 US disclosed
US-7342131-B2 Levodopa prodrugs, and compositions and uses thereof XENOPORT, INC. (US) 2008-03-11 US disclosed
US-20050282891-A1 Levodopa prodrugs, and compositions and uses thereof WILSHIRE PHARMACEUTICALS, INC. 2005-12-22 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 (7 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-20110201817-A1 LEVODOPA PRODRUGS, AND COMPOSITIONS AND USES THEREOF COMT, DDT, DDC LMNA 2387/4885CYP1A2 972/4885CYP2D6 124/4885
US-20080132570-A1 Levodopa prodrugs, and compositions and uses thereof COMT, DDT, DDC LMNA 2387/4885CYP1A2 972/4885CYP2D6 124/4885
US-20100197953-A9 LEVODOPA PRODRUGS, AND COMPOSITIONS AND USES THEREOF COMT, DDT, DDC LMNA 2387/4885CYP1A2 972/4885CYP2D6 124/4885
US-20050282891-A1 Levodopa prodrugs, and compositions and uses thereof COMT, DDT, DDC LMNA 2387/4885CYP1A2 972/4885CYP2D6 124/4885
US-20120190861-A1 Levodopa Prodrugs, and Compositions and Uses Thereof COMT, DDT, DDC LMNA 2387/4885CYP1A2 972/4885CYP2D6 124/4885
US-20190308934-A1 Prodrugs of Chlorokynurenines KMO, CYP2A13, KYNU LMNA 2862/4885CYP1A2 40/4885CYP2D6 13/4885
US-20090137834-A1 LEVODOPA PRODRUGS, AND COMPOSITIONS AND USES THEREOF COMT, DDT, DDC LMNA 2387/4885CYP1A2 972/4885CYP2D6 124/4885

“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.