SCHEMBL30649299

SCHEMBL30649299

CS(=O)(=O)c1ccc(C2c3ccccc3-c3cncn32)cc1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 20/20 0.52
TDO2 P48775 6/20 0.52
CYP3A4 P08684 2/20 0.52

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
SCHEMBL20602729 1.00 IDO1 (0.52) IDO1TDO2CYP3A4
SCHEMBL20621024 0.82 IDO1 (0.62) IDO1TDO2CYP3A4
SCHEMBL20621023 0.82 IDO1 (0.62) IDO1TDO2CYP3A4
SCHEMBL20602751 0.82 IDO1 (0.62) IDO1TDO2CYP3A4
SCHEMBL20602670 0.79 IDO1 (0.58) IDO1TDO2CYP3A4
SCHEMBL20602779 0.77 IDO1 (0.45) IDO1TDO2CYP3A4
SCHEMBL20602777 0.77 IDO1 (0.45) IDO1TDO2CYP3A4
SCHEMBL20602807 0.77 IDO1 (0.45) IDO1TDO2CYP3A4
SCHEMBL30649064 0.77 IDO1 (0.45) IDO1TDO2CYP3A4
SCHEMBL30649222 0.76 IDO1 (0.43) IDO1TDO2CYP3A4

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-20240132507-A1 TDO2 and IDO1 Inhibitors GENENTECH, INC. 2024-04-25 US disclosed
US-11827639-B2 TDO2 and IDO1 inhibitors GENENTECH, INC. (US) 2023-11-28 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 (2 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-20240132507-A1 TDO2 and IDO1 Inhibitors IDO1, TDO2, IDO2 IDO1 1/4885TDO2 2/4885CYP3A4 428/4885
US-11827639-B2 TDO2 and IDO1 inhibitors IDO1, TDO2, IDO2 IDO1 1/4885TDO2 2/4885CYP3A4 428/4885

“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.