SCHEMBL3022388

SCHEMBL3022388

[CH2]COC(=O)c1ccc(F)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.51
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
CASP3 P42574 1/20 0.51
TRPV1 Q8NER1 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
LMNA P02545 3/20 0.49
ADRB2 P07550 2/20 0.49
ADRB1 P08588 2/20 0.49
ADRB3 P13945 2/20 0.49
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 5/20 0.45
RAB9A P51151 5/20 0.45
PTPN1 P18031 1/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
HTT P42858 3/20 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
SCHEMBL3026131 0.84 KMT2A (0.49) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL21815741 0.81 PTPN1 (0.57) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL4570567 0.79 KMT2A (0.75) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL557321 0.79 MAPT (0.51) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL62862 0.79 KMT2A (0.75) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL8742866 0.79 TDP1 (0.57) MAPTKMT2ATRPV1LMNAADRB2
SCHEMBL6964934 0.79 GAA (0.53) MAPTKMT2AMEN1LMNACES2
SCHEMBL21953575 0.79 KMT2A (0.51) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL555991 0.79 KMT2A (0.51) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL8743221 0.79 HPGD (0.56) MAPTKMT2AMEN1LMNACES2

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100197953-A9 LEVODOPA PRODRUGS, AND COMPOSITIONS AND USES THEREOF XENOPORT, INC. (US) 2010-08-05 US claimed
US-20090137834-A1 LEVODOPA PRODRUGS, AND COMPOSITIONS AND USES THEREOF XENOPORT, INC. (US) 2009-05-28 US claimed
US-7534813-B2 Levodopa prodrugs, and compositions and uses thereof XENOPORT, INC. (US) 2009-05-19 US claimed
US-7342131-B2 Levodopa prodrugs, and compositions and uses thereof XENOPORT, INC. (US) 2008-03-11 US claimed
EP-1751087-A1 LEVODOPA PRODRUGS, AND COMPOSITIONS AND USES THEREOF Xenoport, Inc. (US) 2007-02-14 EP claimed
WO-2005121069-A1 LEVODOPA PRODRUGS, AND COMPOSITIONS AND USES THEREOF XENOPORT, INC. (US) 2005-12-22 WO claimed
US-20050282891-A1 Levodopa prodrugs, and compositions and uses thereof WILSHIRE PHARMACEUTICALS, INC. 2005-12-22 US claimed
EP-1751087-B1 LEVODOPA DERIVATIVES, AND COMPOSITIONS AND USES THEREOF XENOPORT INC (US) 2012-06-27 EP 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
WO-2008034087-A2 TREATING SCHIZOPHRENIA WITH COMBINATIONS OF LEVODOPA AND AN ANTIPSYCHOTIC AGENT XENOPORT, INC. (US) 2008-03-20 WO disclosed
US-5972955-A ANTITUMOR AGENTS TREATING CANCER, VIRICIDES DR. REDDY'S RESEARCH FOUNDATION (IN) 1999-10-26 US disclosed
EP-0906316-A1 NOVEL WATER-SOLUBLE ANALOGUES OF 20(S)-CAMPTOTHECIN DR. REDDY'S RESEARCH FOUNDATION (IN) 1999-04-07 EP disclosed
EP-0906317-A1 NOVEL WATER-SOLUBLE C-RING ANALOGUES OF 20(S)-CAMPTOTHECIN DR. REDDY'S RESEARCH FOUNDATION (IN) 1999-04-07 EP disclosed
EP-0847397-A1 NOVEL WATER-SOLUBLE C-RING ANALOGUES OF 20 (S)-CAMPTOTHECIN DR. REDDY'S RESEARCH FOUNDATION (IN) 1998-06-17 EP disclosed
WO-1997046563-A1 NOVEL WATER-SOLUBLE C-RING ANALOGUES OF 20 (S)-CAMPTOTHECIN DR. REDDY'S RESEARCH FOUNDATION (IN) 1997-12-11 WO disclosed
WO-1997046562-A1 NOVEL WATER-SOLUBLE C-RING ANALOGUES OF 20(S)-CAMPTOTHECIN DR. REDDY'S RESEARCH FOUNDATION (IN) 1997-12-11 WO disclosed
WO-1997046564-A1 NOVEL WATER-SOLUBLE ANALOGUES OF 20(S)-CAMPTOTHECIN DR. REDDY'S RESEARCH FOUNDATION (IN) 1997-12-11 WO 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 (4 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-20080132570-A1 Levodopa prodrugs, and compositions and uses thereof COMT, DDT, DDC MAPT 1341/4885KMT2A 1568/4885MEN1 1821/4885
US-20100197953-A9 LEVODOPA PRODRUGS, AND COMPOSITIONS AND USES THEREOF COMT, DDT, DDC MAPT 1341/4885KMT2A 1568/4885MEN1 1821/4885
US-20050282891-A1 Levodopa prodrugs, and compositions and uses thereof COMT, DDT, DDC MAPT 1341/4885KMT2A 1568/4885MEN1 1821/4885
US-20090137834-A1 LEVODOPA PRODRUGS, AND COMPOSITIONS AND USES THEREOF COMT, DDT, DDC MAPT 1341/4885KMT2A 1568/4885MEN1 1821/4885

“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.