SCHEMBL6748282

SCHEMBL6748282

CCCCCCCC(=O)CCCCCC/C=C/[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@](O)(CC(=O)O)C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPTLC1 O15269 1/20 0.76
SPTLC2 O15270 1/20 0.76
FAAH O00519 2/20 0.49
CNR1 P21554 1/20 0.46
MME P08473 6/20 0.44
ACE P12821 6/20 0.44
CPA1 P15085 2/20 0.44
ACE2 Q9BYF1 2/20 0.44
GRIA1 P42261 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
NAALAD2 Q9Y3Q0 1/20 0.40
PSMB11 A5LHX3 1/20 0.39
PSMA7 O14818 1/20 0.39
PSMB1 P20618 1/20 0.39
PSMA1 P25786 1/20 0.39
PSMA2 P25787 1/20 0.39
PSMA3 P25788 1/20 0.39
PSMA4 P25789 1/20 0.39
PSMB8 P28062 1/20 0.39

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
SCHEMBL16944314 0.94 SPTLC1 (0.68) SPTLC1SPTLC2FAAHCNR1MME
SCHEMBL17518727 0.94 SPTLC1 (0.68) SPTLC1SPTLC2FAAHCNR1GRIA1
SCHEMBL16944362 0.93 SPTLC1 (0.67) SPTLC1SPTLC2FAAHCNR1GRIA1
SCHEMBL16944292 0.93 SPTLC1 (0.69) SPTLC1SPTLC2FAAHCNR1MME
SCHEMBL16944319 0.93 SPTLC1 (0.67) SPTLC1SPTLC2FAAHCNR1MME
SCHEMBL10082711 0.93 SPTLC1 (0.76) SPTLC1SPTLC2FAAHCNR1MME
SCHEMBL6802874 0.93 SPTLC1 (0.76) SPTLC1SPTLC2FAAHCNR1MME
SCHEMBL31618543 0.93 SPTLC1 (0.75) SPTLC1SPTLC2FAAHMMEACE
SCHEMBL6804868 0.92 SPTLC1 (0.75) SPTLC1SPTLC2FAAHMMEACE
SCHEMBL14190672 0.92 SPTLC1 (0.75) SPTLC1SPTLC2FAAHMMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220288004-A1 TREATMENT AND PREVENTION OF AGING RELATED-DISEASE AND/OR AGING BY THE INHIBITION OF SPHINGOLIPIDS ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2022-09-15 US disclosed
US-20150210666-A1 ORALLY AVAILABLE VIRIDIOFUNGIN DERIVATIVE POSSESSING ANTI-HCV ACTIVITY CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2015-07-30 US disclosed
US-20150148387-A1 METHODS OF TREATMENT, DIAGNOSIS AND MONITORING FOR METHAMPHETAMINE TOXICITY WHICH TARGET CERAMIDE METABOLIC PATHWAYS AND CELLULAR SENESCENCE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2015-05-28 US disclosed
US-20150148387-A1 METHODS OF TREATMENT, DIAGNOSIS AND MONITORING FOR METHAMPHETAMINE TOXICITY WHICH TARGET CERAMIDE METABOLIC PATHWAYS AND CELLULAR SENESCENCE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2015-05-28 US disclosed
WO-2013149250-A1 METHODS OF TREATMENT, DIAGNOSIS AND MONITORING FOR METHAMPHETAMINE TOXICITY WHICH TARGET CERAMIDE METABOLIC PATHWAYS AND CELLULAR SENESCENCE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-10-03 WO disclosed
US-8183005-B1 Pharmaceutical agents for treating HCV infections CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-05-22 US disclosed
US-8183005-B1 Pharmaceutical agents for treating HCV infections CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-05-22 US disclosed
US-20110160252-A1 PHARMACEUTICAL COMPOSITIONS FOR TREATMENT OR PREVENTION OF HBV INFECTION PUBLIC UNIVERSITY CORPORATION NAGOYA CITY UNIVERSITY (JP) 2011-06-30 US disclosed
US-20110160252-A1 PHARMACEUTICAL COMPOSITIONS FOR TREATMENT OR PREVENTION OF HBV INFECTION PUBLIC UNIVERSITY CORPORATION NAGOYA CITY UNIVERSITY (JP) 2011-06-30 US disclosed
US-20110098477-A1 Method Of Producing Compound Having Anti-Hcv Activity CHUGAI SEIYAKU KABUSHIKI KAISHA 2011-04-28 US disclosed
US-7897783-B2 Intermediate compound for synthesis of viridiofungin a derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2011-03-01 US disclosed
US-20100274026-A1 Virus therapeutic drug CHUGAI SEIYAKU KABUSHIKI KAISHA 2010-10-28 US disclosed
US-20100274026-A1 Virus therapeutic drug CHUGAI SEIYAKU KABUSHIKI KAISHA 2010-10-28 US disclosed
US-7776918-B2 Remedy for viral disease CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-08-17 US disclosed
US-7776918-B2 Remedy for viral disease CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-08-17 US disclosed
US-20080293950-A1 Production Process of Compound Having Anti-Hcv Action and Intermediate Thereof CHUGAI SEIYAKU KABUSHIKI KAISHA 2008-11-27 US disclosed
US-7378446-B2 Compound having anti-HCV activity and process for producing the same CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2008-05-27 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-20150148387-A1 METHODS OF TREATMENT, DIAGNOSIS AND MONITORING FOR METHAMPHETAMINE TOXICITY WHICH TARGET CERAMIDE METABOLIC PATHWAYS AND CELLULAR SENESCENCE CERS2, CHKB, CES2 SPTLC1 30/4885SPTLC2 15/4885FAAH 80/4885
US-20220288004-A1 TREATMENT AND PREVENTION OF AGING RELATED-DISEASE AND/OR AGING BY THE INHIBITION OF SPHINGOLIPIDS SMPD3, SMPD2, SMPD1 SPTLC1 7/4885SPTLC2 6/4885FAAH 124/4885
US-20150210666-A1 ORALLY AVAILABLE VIRIDIOFUNGIN DERIVATIVE POSSESSING ANTI-HCV ACTIVITY ZC3HAV1, SLC10A1, CYP51A1 SPTLC1 1254/4885SPTLC2 2323/4885FAAH 2913/4885
US-20080293950-A1 Production Process of Compound Having Anti-Hcv Action and Intermediate Thereof HCCS, EIF2AK2, MAVS SPTLC1 3812/4885SPTLC2 4077/4885FAAH 4333/4885
US-20110098477-A1 Method Of Producing Compound Having Anti-Hcv Activity ERG28, HCCS, BCAT2 SPTLC1 925/4885SPTLC2 2385/4885FAAH 3257/4885
US-20100274026-A1 Virus therapeutic drug HAVCR2, ZC3HAV1, EIF2AK2 SPTLC1 2899/4885SPTLC2 2848/4885FAAH 4349/4885
US-20110160252-A1 PHARMACEUTICAL COMPOSITIONS FOR TREATMENT OR PREVENTION OF HBV INFECTION IFNG, HDGF, HAVCR2 SPTLC1 4049/4885SPTLC2 4400/4885FAAH 2496/4885

“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.