SCHEMBL5914830

SCHEMBL5914830

CCOC(=O)C1CSC(c2ccccc2)=N1

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.44
TRPM8 Q7Z2W7 2/20 0.42
CDC7 O00311 1/20 0.42
DBF4 Q9UBU7 1/20 0.42
HTR2B P41595 1/20 0.41
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL8831892 1.00 TSHR (0.46) TSHRMAPTRAB9ATRPM8CDC7
SCHEMBL13885706 0.88 MAPT (0.46) TSHRMAPTTRPM8HTR2BALDH1A1
SCHEMBL12130911 0.87 DPP4 (0.43) TSHRMAPTALDH1A1
SCHEMBL5622788 0.85 MAPT (0.49) TSHRMAPTRAB9AALDH1A1
SCHEMBL14481262 0.84 MAPT (0.44) TSHRMAPTTRPM8HTR2BALDH1A1
SCHEMBL17898128 0.82 RARB (0.44) TSHRMAPTALDH1A1
SCHEMBL4415767 0.79 HTR2B (0.49) TSHRMAPTRAB9AHTR2B
SCHEMBL723266 0.79 HTR2B (0.49) TSHRMAPTRAB9AHTR2B
SCHEMBL1683655 0.79 HTR2B (0.49) TSHRMAPTRAB9AHTR2B
SCHEMBL6829016 0.78 ALOX5 (0.42) TSHRMAPTRAB9ATRPM8CDC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060069134-A1 Process for producing optically active alpha-substituted cysteine or salt thereof, intermediate therefor, and process for producing the same KANEKA CORPORATION (JP) 2006-03-30 US disclosed
EP-1548013-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE ALPHA-SUBSTITUTED CYSTEINE OR SALT THEREOF, INTERMEDIATE THEREFOR, AND PROCESS FOR PRODUCING THE SAME KANEKA CORPORATION (JP) 2005-06-29 EP disclosed
US-6894170-B2 Process for the preparation of substituted thiazolines and their intermediates DSM FINE CHEMICALS AUSTRIA NFG GMBH & CO KG (AT) 2005-05-17 US disclosed
US-20050101782-A1 Process for the preparation of substituted thiazolines and their intermediates KRICH SYLVIA (AT) 2005-05-12 US disclosed
US-20030088105-A1 Process for the preparation of substituted thiazolines and their intermediates DSM FINE CHEMICALS AUSTRIA NFG GMBH & COKG (AT) 2003-05-08 US disclosed
EP-1302467-A2 Process for the preparation of substituted thiazoline derivatives and their intermediate DSM Fine Chemicals Austria Nfg GmbH & Co KG (AT) 2003-04-16 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 (3 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-20030088105-A1 Process for the preparation of substituted thiazolines and their intermediates CBR1, RCOR1, MT-CO1 TSHR 913/4885MAPT 1838/4885RAB9A 1369/4885
US-20060069134-A1 Process for producing optically active alpha-substituted cysteine or salt thereof, intermediate therefor, and process for producing the same CTH, SLC7A11, CBS TSHR 3648/4885MAPT 3644/4885RAB9A 2729/4885
US-20050101782-A1 Process for the preparation of substituted thiazolines and their intermediates CBR1, CBR3, MT-CO1 TSHR 1045/4885MAPT 2823/4885RAB9A 1828/4885

“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.