SCHEMBL29649290

SCHEMBL29649290

O=C1c2ccccc2CC1C1c2ccccc2-c2cncn21

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 19/20 0.59
TDO2 P48775 16/20 0.59
CYP3A4 P08684 7/20 0.54

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
SCHEMBL19044189 1.00 IDO1 (0.59) IDO1TDO2CYP3A4
SCHEMBL19044240 0.90 IDO1 (0.54) IDO1TDO2CYP3A4
SCHEMBL19044422 0.88 IDO1 (0.61) IDO1TDO2CYP3A4
SCHEMBL19044219 0.85 IDO1 (0.51) IDO1TDO2CYP3A4
SCHEMBL29945343 0.85 IDO1 (0.51) IDO1TDO2CYP3A4
SCHEMBL19029707 0.80 IDO1 (0.56) IDO1TDO2CYP3A4
SCHEMBL29945511 0.80 IDO1 (0.56) IDO1TDO2CYP3A4
SCHEMBL19043962 0.79 IDO1 (0.61) IDO1TDO2CYP3A4
SCHEMBL19043963 0.79 IDO1 (0.61) IDO1TDO2CYP3A4
SCHEMBL29649312 0.79 IDO1 (0.61) 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-20220306635-A1 TDO2 Inhibitors GENENTECH, INC. 2022-09-29 US disclosed
CN-110072864-B TDO2 inhibitors 基因泰克公司 2022-05-27 CN 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-20220306635-A1 TDO2 Inhibitors TDO2, IDO2, IDO1 IDO1 3/4885TDO2 1/4885CYP3A4 417/4885

“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.