SCHEMBL31028252

SCHEMBL31028252

CC(C)(C)OC(=O)N[C@H](CCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.47
NPSR1 Q6W5P4 5/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPT P10636 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
CTSS P25774 3/20 0.44
HDAC4 P56524 2/20 0.44
HDAC1 Q13547 2/20 0.44
PAX8 Q06710 1/20 0.44
P2RY2 P41231 1/20 0.43
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
JAK3 P52333 1/20 0.43
BTK Q06187 1/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
PPARA Q07869 2/20 0.42
HDAC3 O15379 1/20 0.42

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
SCHEMBL955903 0.93 ALDH1A1 (0.48) CTSKALDH1A1CTSSHDAC4HDAC1
SCHEMBL28821322 0.93 ALDH1A1 (0.48) CTSKALDH1A1CTSSHDAC4HDAC1
SCHEMBL955905 0.93 ALDH1A1 (0.48) CTSKALDH1A1CTSSHDAC4HDAC1
SCHEMBL15699370 0.92 CTSK (0.48) CTSKMAPTCTSSPPARA
SCHEMBL952620 0.92 CTSK (0.48) CTSKMAPTCTSSPPARA
SCHEMBL952619 0.92 CTSK (0.48) CTSKMAPTCTSSPPARA
SCHEMBL20562067 0.90 ALDH1A1 (0.50) CTSKALDH1A1CTSSHDAC4HDAC1
SCHEMBL20562065 0.90 ALDH1A1 (0.50) CTSKALDH1A1CTSSHDAC4HDAC1
SCHEMBL31526993 0.88 KLK5 (0.46) CTSKCTSSCTSLCTSBJAK3
SCHEMBL31028245 0.86 ATM (0.43) CTSKCTSSHDAC4HDAC1CTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12371434-B2 MLL1 inhibitors and anti-cancer agents CHINA NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH CO., LTD. (CN) 2025-07-29 US disclosed
EP-4013754-B1 MLL1 INHIBITORS AND ANTI-CANCER AGENTS NOVARTIS AG (CH) 2024-07-24 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-12371434-B2 MLL1 inhibitors and anti-cancer agents MLLT1, BMI1, DOT1L CTSK 4303/4885NPSR1 4694/4885MEN1 527/4885

“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.