SCHEMBL21912392

SCHEMBL21912392

O=C(OC1CC2CCC1C2)c1cc(I)cc(I)c1I

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRM1 Q13255 6/20 0.46
▸ ATM Q13315 1/20 0.40
▸ CYP19A1 P11511 1/20 0.40
▸ PDE4A P27815 3/20 0.33
▸ PDE4B Q07343 3/20 0.33
▸ PDE4C Q08493 3/20 0.33
▸ PDE4D Q08499 3/20 0.33
▸ IRAK4 Q9NWZ3 3/20 0.33
▸ SCN9A Q15858 2/20 0.33

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
SCHEMBL19678504 0.76 — —
SCHEMBL19678486 0.75 — —
SCHEMBL22945419 0.75 CHRNA7 (0.50) —
SCHEMBL26833113 0.72 CHRNA7 (0.51) —
SCHEMBL22277820 0.72 ATM (0.40) ATM
SCHEMBL26834880 0.70 PLAT (0.37) ATM
SCHEMBL9402766 0.70 GRM1 (0.48) GRM1ATMCYP19A1PDE4APDE4B
SCHEMBL21912393 0.70 SERPINE1 (0.35) ATM
SCHEMBL26426710 0.70 HTR3E (0.56) —
SCHEMBL22403232 0.69 SCN9A (0.30) SCN9A

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-10613437-B2 Resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-04-07 — — 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-10613437-B2 Resist composition and patterning process INSR, EWSR1, INSRR GRM1 3194/4885ATM 2894/4885CYP19A1 4523/4885

“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.

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