SCHEMBL3854199

SCHEMBL3854199

C=CC[C@@](N)(CS)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.35
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
THRB P10828 1/20 0.32
KMT2A Q03164 1/20 0.32
ODC1 P11926 1/20 0.31

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
SCHEMBL1416683 1.00 ALDH1A1 (0.37) ALDH1A1TSHRHTTMEN1CYP1A2
SCHEMBL1416684 1.00 ALDH1A1 (0.37) ALDH1A1TSHRHTTMEN1CYP1A2
Hydrogen Sulfide SCHEMBL27650551 0.98 ALDH1A1 (0.36) ALDH1A1TSHRHTTMEN1CYP1A2
SCHEMBL27514629 0.96 ALDH1A1 (0.35) ALDH1A1TSHRHTTMEN1CYP1A2
SCHEMBL30651 0.86 ALDH1A1 (0.42) ALDH1A1TSHRHTTMEN1CYP1A2
SCHEMBL3852636 0.83 HTT (0.39) ALDH1A1TSHRHTT
SCHEMBL3853291 0.83 HTT (0.39) ALDH1A1TSHRHTT
SCHEMBL3852641 0.83 HTT (0.39) ALDH1A1TSHRHTT
SCHEMBL30787966 0.80 ARG2 (0.41) ALDH1A1TSHRHTTMEN1CYP1A2
SCHEMBL11087825 0.78 ODC1 (0.48) ALDH1A1TSHRHTTMEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1686114-B1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 2-ALKYLCYSTEINE, DERIVATIVE THEREOF, AND PROCESSES FOR PRODUCTION MITSUBISHI GAS CHEMICAL CO (JP) 2009-10-07 EP claimed
US-20090030210-A1 Process for Producing Optically Active 2-Alkylcysteine, Derivative Thereof, and Processes for Production MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2009-01-29 US claimed
US-7470525-B2 Process for producing optically active 2-alkycysteine, derivative thereof, and processes for production MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2008-12-30 US claimed
US-20070037260-A1 allowing cells of microorganism or treated products thereof having an activity of stereoselective hydrolysis of the amide bond of a 2-alkyl-L-cysteinamide or a salt thereof to act on a 2-alkylcysteinamide consisting of a mixture of D- and L-isomers or a salt thereof MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2007-02-15 US claimed
EP-1686114-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 2-ALKYLCYSTEINE, DERIVATIVE THEREOF, AND PROCESSES FOR PRODUCTION MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2006-08-02 EP claimed
EP-1686114-B1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 2-ALKYLCYSTEINE, DERIVATIVE THEREOF, AND PROCESSES FOR PRODUCTION MITSUBISHI GAS CHEMICAL CO (JP) 2009-10-07 EP disclosed
EP-1686114-B1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 2-ALKYLCYSTEINE, DERIVATIVE THEREOF, AND PROCESSES FOR PRODUCTION MITSUBISHI GAS CHEMICAL CO (JP) 2009-10-07 EP disclosed
EP-1529037-B1 SYNTHESIS OF 2-ALKYLCYSTEINES, 2-(HYDROXYLATED PHENYL)-4-ALKYLTHIAZOLINE-4-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF GENZYME CORP (US) 2009-07-15 EP disclosed
US-20090030210-A1 Process for Producing Optically Active 2-Alkylcysteine, Derivative Thereof, and Processes for Production MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2009-01-29 US disclosed
US-20090030210-A1 Process for Producing Optically Active 2-Alkylcysteine, Derivative Thereof, and Processes for Production MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2009-01-29 US disclosed
US-7470525-B2 Process for producing optically active 2-alkycysteine, derivative thereof, and processes for production MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2008-12-30 US disclosed
US-7470525-B2 Process for producing optically active 2-alkycysteine, derivative thereof, and processes for production MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2008-12-30 US disclosed
US-6878828-B2 Synthesis of 2-alkylcysteine via substituted thiazoline ester GENZYME CORPORATION (US) 2005-04-12 US disclosed
US-6861532-B2 Synthesis of 2-alkylcysteine GENZYME CORPORATION (US) 2005-03-01 US disclosed
US-6794515-B2 CONDENSING CYSTEINE WITH CABOCYCLIC NITRILES TO FORM 2-ARYLTHIAZOLINE-4-CARBOXYLIC ACID, THEN AMIDATION, ALKYLATION, HYDROLYZING AND OPTIONALLY PURIFYING TO FORM 2-METHYLCYSTEINE GENZYME CORPORATION 2004-09-21 US disclosed
US-20030236435-A1 Synthesis of 2-alkylcysteine via substituted thiazoline ester GENZYME CORPORATION 2003-12-25 US disclosed
US-20030236434-A1 Synthesis of 2-alkylcysteine via substituted thiazoline amide GENZYME CORPORATION (US) 2003-12-25 US disclosed
US-20030236404-A1 Synthesis of 2-alkylcysteine via phase transfer catalysis GENZYME CORPORATION 2003-12-25 US disclosed
US-20030229231-A1 Synthesis of 2-alkylcysteine GENZYME CORPORATION 2003-12-11 US disclosed
WO-2003097622-A2 SYNTHESIS OF 2-ALKYLCYSTEINES, 2-(HYDROXYLATED PHENYL)-4-ALKYLTHIAZOLINE-4-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF GENZYME CORPORATION (US) 2003-11-27 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 (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-20030236404-A1 Synthesis of 2-alkylcysteine via phase transfer catalysis DIMT1, ICMT, CNDP2 ALDH1A1 2230/4885TSHR 1787/4885HTT 297/4885
US-20030236435-A1 Synthesis of 2-alkylcysteine via substituted thiazoline ester FTH1, TFRC, CNDP2 ALDH1A1 751/4885TSHR 178/4885HTT 562/4885
US-20030229231-A1 Synthesis of 2-alkylcysteine FTH1, CISD2, CNDP2 ALDH1A1 3782/4885TSHR 499/4885HTT 208/4885
US-20090030210-A1 Process for Producing Optically Active 2-Alkylcysteine, Derivative Thereof, and Processes for Production AADAT, CBS, CTH ALDH1A1 444/4885TSHR 4348/4885HTT 1136/4885
US-20030236434-A1 Synthesis of 2-alkylcysteine via substituted thiazoline amide CNDP2, FTH1, PTMS ALDH1A1 2802/4885TSHR 485/4885HTT 298/4885

“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.