SCHEMBL29997527

SCHEMBL29997527

COc1ccccc1C[C@H]1[C@H](O[Si](C)(C)C(C)(C)C)CCN1C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 1/20 0.38
▸ TSHR P16473 2/20 0.38
▸ ITGA4 P13612 1/20 0.37
▸ ITGB7 P26010 1/20 0.37
▸ ATM Q13315 2/20 0.37
▸ P2RX3 P56373 2/20 0.37
▸ HPGD P15428 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ KLK7 P49862 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL29998145 1.00 CYP2D6 (0.38) CYP2D6TSHRITGA4ITGB7ATM
SCHEMBL23459316 0.89 SMN1; SMN2 (0.40) CYP2D6ATMHPGDSMN1; SMN2ALDH1A1
SCHEMBL25697961 0.83 ATM (0.44) CYP2D6TSHRITGA4ITGB7ATM
SCHEMBL29997800 0.83 ATM (0.44) CYP2D6TSHRITGA4ITGB7ATM
SCHEMBL23528214 0.83 ATM (0.44) CYP2D6TSHRITGA4ITGB7ATM
SCHEMBL29997324 0.82 CYP2D6 (0.43) CYP2D6TSHRHPGDSMN1; SMN2ALDH1A1
SCHEMBL29997790 0.82 CYP2D6 (0.43) CYP2D6TSHRHPGDSMN1; SMN2ALDH1A1
SCHEMBL29997825 0.81 CYP2D6 (0.42) CYP2D6TSHRITGA4ITGB7ATM
SCHEMBL12979137 0.78 ALDH1A1 (0.37) TSHRSMN1; SMN2ALDH1A1
SCHEMBL24411299 0.78 ALDH1A1 (0.37) TSHRSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4069366-B1 ATM KINASE INHIBITORS AND COMPOSITIONS AND METHODS OF USE THEREOF CHDI FOUNDATION INC (US) 2025-03-19 — — EP disclosed
US-11685734-B2 ATM kinase inhibitors and compositions and methods of use thereof CHDI FOUNDATION, INC. (US) 2023-06-27 — — US disclosed
EP-4069366-A1 ATM KINASE INHIBITORS AND COMPOSITIONS AND METHODS OF USE THEREOF CHDI Foundation, Inc. (US) 2022-10-12 — — EP 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-11685734-B2 ATM kinase inhibitors and compositions and methods of use thereof ATM, CHEK2, CHEK1 CYP2D6 4579/4885TSHR 3766/4885ITGA4 3985/4885

“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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