SCHEMBL25698598

SCHEMBL25698598

COc1ccccc1C[C@@H]1CCC[C@H]1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.39
▸ CYP2D6 P10635 1/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ GAA P10253 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ IDO1 P14902 2/20 0.37
▸ HRH3 Q9Y5N1 2/20 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
SCHEMBL31324554 0.77 TACR1 (0.53) HPGDMEN1KMT2ALMNAGAA
SCHEMBL23459316 0.73 SMN1; SMN2 (0.40) HPGDCYP2D6MEN1KMT2AALDH1A1
SCHEMBL25698592 0.73 HPGD (0.46) HPGDCYP2D6MEN1KMT2ALMNA
SCHEMBL25698600 0.73 CA1 (0.53) HPGDCYP2D6MEN1KMT2ALMNA
SCHEMBL6555758 0.70 PPM1D (0.34) —
SCHEMBL8320390 0.69 TACR1 (0.43) —
SCHEMBL8325298 0.69 TACR1 (0.43) —
SCHEMBL12634818 0.69 PPM1D (0.40) —
SCHEMBL24501491 0.69 PPM1D (0.40) —
SCHEMBL20527910 0.69 PPM1D (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 1 patent. 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

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 HPGD 2657/4885CYP2D6 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.

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