Methopterine

Methopterine

SCHEMBL6907131

CN(Cc1cnc2nc(N)nc(O)c2n1)c1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1

nearest known ligand 0.86

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPGS Q05932 3/20 0.86
DHFR P00374 3/20 0.86
KDM4E B2RXH2 1/20 0.86
TLR4 O00206 1/20 0.86
MEN1 O00255 1/20 0.86
ALDH1A1 P00352 1/20 0.86
LMNA P02545 1/20 0.86
TP53 P04637 1/20 0.86
TYMS P04818 1/20 0.86
GLA P06280 1/20 0.86
POLB P06746 1/20 0.86
HMGB1 P09429 1/20 0.86
MAPT P10636 1/20 0.86
FOLR2 P14207 1/20 0.86
FOLR1 P15328 1/20 0.86
HPGD P15428 1/20 0.86
ALOX15 P16050 1/20 0.86
ALOX12 P18054 1/20 0.86
GART P22102 1/20 0.86
APEX1 P27695 1/20 0.86

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
Methopterine SCHEMBL159228 1.00 FPGS (0.86) FPGSDHFRKDM4ETLR4MEN1
Methopterine SCHEMBL10658766 0.99 FPGS (0.84) FPGSDHFRKDM4ETLR4MEN1
Methotrexate SCHEMBL9736207 0.97 DHFR (0.92) FPGSDHFRKDM4ETLR4MEN1
Methotrexate SCHEMBL2301949 0.92 DHFR (1.00) FPGSDHFRKDM4ETLR4MEN1
Methotrexate SCHEMBL3712 0.92 DHFR (1.00) FPGSDHFRKDM4ETLR4MEN1
Methotrexate SCHEMBL16013534 0.92 DHFR (1.00) FPGSDHFRKDM4ETLR4MEN1
Methotrexate SCHEMBL171251 0.92 DHFR (1.00) FPGSDHFRKDM4ETLR4MEN1
Methotrexate SCHEMBL20548444 0.92 DHFR (1.00) FPGSDHFRKDM4ETLR4MEN1
Methotrexate SCHEMBL3711 0.92 DHFR (1.00) FPGSDHFRKDM4ETLR4MEN1
SCHEMBL13524540 0.92 DHFR (0.87) FPGSDHFRKDM4ETLR4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2752422-B1 Stereoselective synthesis of phosphorus containing actives GILEAD PHARMASSET LLC (US) 2017-08-16 EP disclosed
US-8859756-B2 Stereoselective synthesis of phosphorus containing actives GILEAD PHARMASSET LLC (US) 2014-10-14 US disclosed
EP-2552931-B1 STEREOSELECTIVE SYNTHESIS OF PHOSPHORUS CONTAINING ACTIVES GILEAD PHARMASSET LLC (US) 2014-07-23 EP disclosed
EP-2752422-A1 Stereoselective synthesis of phosphorus containing actives Gilead Pharmasset LLC (US) 2014-07-09 EP disclosed
WO-2011123668-A2 STEREOSELECTIVE SYNTHESIS OF PHOSPHORUS CONTAINING ACTIVES PHARMASSET, INC. (US) 2011-10-06 WO disclosed
US-20110245484-A1 STEREOSELECTIVE SYNTHESIS OF PHOSPHORUS CONTAINING ACTIVES PHARMASSET, INC. (US) 2011-10-06 US disclosed
US-6689756-B2 VIA CATHETER COMPRISING ANTIMICROBIAL AGENT AND SECOND CATHETER FOR WITHDRAWING FLUID; FOR TREATING INFECTION OR NEOPLASM OF CEREBROSPINAL TISSUE INTEGRA LIFESCIENCES CORPORATION 2004-02-10 US disclosed
US-20030022879-A1 Treatment of neurological disease INTEGRA LIFESCIENCES CORPORATION 2003-01-30 US disclosed
WO-2002069893-A2 TREATMENT OF NEUROLOGICAL DISEASE NEURON THERAPEUTICS, INC. (US) 2002-09-12 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 (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-20110245484-A1 STEREOSELECTIVE SYNTHESIS OF PHOSPHORUS CONTAINING ACTIVES PPA1, ENPP1, ITPA FPGS 790/4885DHFR 1717/4885KDM4E 4417/4885

“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.