SCHEMBL6469019

SCHEMBL6469019

O=C(CS)C[C@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CPA1 P15085 9/20 0.70
CPA3 P15088 3/20 0.68
FOLH1 Q04609 2/20 0.68
CPB1 P15086 1/20 0.68
CPB2 Q96IY4 1/20 0.68
CYP1A2 P05177 1/20 0.66
MME P08473 3/20 0.63
SLC1A3 P43003 1/20 0.53
SLC1A2 P43004 1/20 0.53
SLC1A1 P43005 1/20 0.53

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
SCHEMBL28484063 1.00 CPA1 (0.70) CPA1CPA3FOLH1CPB1CPB2
SCHEMBL17799165 0.87 CPA1 (0.72) CPA1CPA3FOLH1CPB1CPB2
SCHEMBL28901708 0.86 CPA3 (0.54) CPA1CPA3FOLH1CPB1CPB2
SCHEMBL17948789 0.82 CPA1 (0.70) CPA1CPA3FOLH1CPB1CPB2
SCHEMBL28102506 0.82 CPA1 (1.00) CPA1CPA3FOLH1CPB1CPB2
SCHEMBL1177225 0.82 CPA1 (0.70) CPA1CPA3FOLH1CPB1CPB2
SCHEMBL7286643 0.82 CPA1 (0.70) CPA1CPA3FOLH1CPB1CPB2
SCHEMBL10076047 0.82 CPA1 (0.70) CPA1CPA3FOLH1CPB1CPB2
SCHEMBL7540821 0.81 CPA1 (0.72) CPA1CPA3FOLH1CPB1CPB2
SCHEMBL5688996 0.81 CPA1 (1.00) CPA1CPA3FOLH1CPB1CPB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050107468-A1 Process for the preparation of an enantiomerically enriched thio compound DSM IP ASSETS B.V. (NL) 2005-05-19 US disclosed
EP-1453797-A1 PROCESS FOR THE PREPARATION OF AN ENANTIOMERICALLY ENRICHED THIO COMPOUND DSM IP Assets B.V. (NL) 2004-09-08 EP disclosed
EP-1325908-A1 Process for the preparation of an enantiomerically enriched thio compound DSM N.V. (NL) 2003-07-09 EP disclosed
WO-2003051827-A1 PROCESS FOR THE PREPARATION OF AN ENANTIOMERICALLY ENRICHED THIO COMPOUND DSM IP ASSETS B.V. (NL) 2003-06-26 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-20050107468-A1 Process for the preparation of an enantiomerically enriched thio compound SLC7A1, TCP1, TFRC CPA1 2520/4885CPA3 4566/4885FOLH1 2819/4885

“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.