SCHEMBL23022397

SCHEMBL23022397

CC(C)C1CC2CCC(N)C2C1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
NISCH Q9Y2I1 1/20 0.39

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
SCHEMBL23022399 1.00 MEN1 (0.39) MEN1CYP1A2CYP3A4CYP2D6TSHR
SCHEMBL23022398 1.00 MEN1 (0.39) MEN1CYP1A2CYP3A4CYP2D6TSHR
SCHEMBL23774428 0.79 MEN1 (0.41) MEN1CYP1A2CYP3A4CYP2D6TSHR
SCHEMBL22242704 0.75
SCHEMBL232681 0.75
SCHEMBL22553564 0.75
SCHEMBL10188216 0.71 MEN1 (0.37) MEN1CYP1A2CYP3A4CYP2D6TSHR
SCHEMBL29348150 0.71 MEN1 (0.37) MEN1CYP1A2CYP3A4CYP2D6TSHR
SCHEMBL23047553 0.71 MEN1 (0.32) MEN1CYP1A2CYP3A4CYP2D6TSHR
SCHEMBL21626527 0.70 MEN1 (0.35) MEN1CYP1A2CYP3A4CYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210053989-A1 PYRIMIDINE-FUSED CYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF SHANGHAI BLUERAY BIOPHARMA CO., LTD. (CN) 2021-02-25 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 (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-20210053989-A1 PYRIMIDINE-FUSED CYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF PTPN11, PPM1F, PTPRF MEN1 2450/4885CYP1A2 4226/4885CYP3A4 3367/4885

“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.