SCHEMBL5711331

SCHEMBL5711331

COC(=O)C1(C)CSC(c2ccccc2)=N1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HTT P42858 2/20 0.37
TRPM8 Q7Z2W7 1/20 0.35
ALDH1A1 P00352 4/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2C19 P33261 2/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2C9 P11712 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
KDM4E B2RXH2 2/20 0.34
HPGD P15428 2/20 0.34
HSD17B10 Q99714 2/20 0.34
GAA P10253 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
ALOX5 P09917 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL5494622 0.86 ALDH1A1 (0.36) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL29438029 0.85 ALDH1A1 (0.39) ALDH1A1CYP1A2CYP2C19CYP3A4CYP2C9
SCHEMBL6315068 0.85 OPRM1 (0.40) TRPM8ALDH1A1CYP1A2CYP2C19CYP2C9
SCHEMBL6401268 0.85 OPRM1 (0.40) TRPM8ALDH1A1CYP1A2CYP2C19CYP2C9
SCHEMBL5914841 0.85 GRM6 (0.35) MEN1KMT2AALDH1A1GAALMNA
SCHEMBL5914861 0.84 THRB (0.34) ALDH1A1SMN1; SMN2ALOX5NPC1RAB9A
SCHEMBL3958398 0.84 THRB (0.34) ALDH1A1SMN1; SMN2ALOX5NPC1RAB9A
SCHEMBL6315318 0.84 THRB (0.34) ALDH1A1SMN1; SMN2ALOX5NPC1RAB9A
SCHEMBL14481379 0.82 MEN1 (0.38) MEN1KMT2AHTTTRPM8ALDH1A1
SCHEMBL6988447 0.75 ALOX5 (0.33) MEN1KMT2ATRPM8ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060270857-A1 Production methods of thiazoline compounds and optically active alpha-alkylcysteine AJINOMOTO CO., INC. (JP) 2006-11-30 US disclosed
EP-1721902-A1 Production methods of thiazoline compounds and optically active alpha-alkylcysteine Ajinomoto Co., Inc. (JP) 2006-11-15 EP 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-20060270857-A1 Production methods of thiazoline compounds and optically active alpha-alkylcysteine CTH, NAT1, AADAC MEN1 3548/4885KMT2A 3029/4885HTT 1566/4885

“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.