SCHEMBL23459316

SCHEMBL23459316

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

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ FAAH O00519 1/20 0.38
▸ SIGMAR1 Q99720 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ ATM Q13315 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ HPGD P15428 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 0.89 CYP2D6 (0.38) SMN1; SMN2CYP2D6ALDH1A1ATMHPGD
SCHEMBL29997527 0.89 CYP2D6 (0.38) SMN1; SMN2CYP2D6ALDH1A1ATMHPGD
SCHEMBL23459312 0.79 KMT2A (0.49) SMN1; SMN2CYP2D6MEN1KMT2ASIGMAR1
SCHEMBL23459009 0.78 SMN1; SMN2 (0.46) SMN1; SMN2CYP2D6MEN1KMT2ASIGMAR1
SCHEMBL23459007 0.78 SMN1; SMN2 (0.46) SMN1; SMN2CYP2D6MEN1KMT2ASIGMAR1
SCHEMBL3319541 0.77 PPM1D (0.33) —
SCHEMBL27156536 0.77 PPM1D (0.33) —
SCHEMBL25243841 0.74 BRD4 (0.31) —
SCHEMBL25698598 0.73 HPGD (0.39) CYP2D6MEN1KMT2AALDH1A1HPGD
SCHEMBL19857544 0.73 LMNA (0.34) —

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
US-11685734-B2 ATM kinase inhibitors and compositions and methods of use thereof CHDI FOUNDATION, INC. (US) 2023-06-27 — — US disclosed
US-20210188827-A1 ATM KINASE INHIBITORS AND COMPOSITIONS AND METHODS OF USE THEREOF CHDI FOUNDATION, INC. 2021-06-24 — — US disclosed
WO-2021113506-A1 ATM KINASE INHIBITORS AND COMPOSITIONS AND METHODS OF USE THEREOF CHDI FOUNDATION, INC. (US) 2021-06-10 — — WO 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-11685734-B2 ATM kinase inhibitors and compositions and methods of use thereof ATM, CHEK2, CHEK1 SMN1; SMN2 2671/4885CYP2D6 4579/4885MEN1 1920/4885
US-20210188827-A1 ATM KINASE INHIBITORS AND COMPOSITIONS AND METHODS OF USE THEREOF ATM, CHEK2, CHEK1 SMN1; SMN2 2671/4885CYP2D6 4579/4885MEN1 1920/4885

“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.

Send feedback