SCHEMBL25801593

SCHEMBL25801593

CC(C)O[Si](CCCNC(=O)C1CCC(C(C)C)CC1)(OC(C)C)OC(C)C

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.42
ROCK1 Q13464 1/20 0.42
ALDH1A1 P00352 6/20 0.40
TSHR P16473 2/20 0.40
NAAA Q02083 1/20 0.40
MAPT P10636 1/20 0.39
LMNA P02545 2/20 0.38
HPGD P15428 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
GNAI3 P08754 1/20 0.38
GNAO1 P09471 1/20 0.38
GNAI1 P63096 1/20 0.38
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
CYP3A4 P08684 4/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP2C19 P33261 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
SCHEMBL25801607 0.91 ROCK2 (0.43) ROCK2ROCK1ALDH1A1TSHRNAAA
SCHEMBL25801600 0.84 ROCK2 (0.44) ROCK2ROCK1ALDH1A1TSHRLMNA
SCHEMBL25801595 0.82 ROCK2 (0.43) ROCK2ROCK1ALDH1A1TSHRNAAA
SCHEMBL25801740 0.80 NAAA (0.57) ROCK2ROCK1ALDH1A1NAAAMAPT
SCHEMBL24202420 0.79 NAAA (0.64) ALDH1A1NAAAMAPTGNAI3GNAO1
SCHEMBL25801598 0.79 HSD17B10 (0.48) ROCK2ROCK1ALDH1A1TSHRNAAA
SCHEMBL10270570 0.77 ROCK2 (0.45) ROCK2ROCK1ALDH1A1TSHRNAAA
SCHEMBL25801608 0.76 ROCK2 (0.46) ROCK2ROCK1ALDH1A1TSHRNAAA
SCHEMBL20900508 0.75 NAAA (0.41) ROCK2ROCK1ALDH1A1TSHRNAAA
SCHEMBL10270126 0.75 HSD17B10 (0.57) ROCK2ROCK1ALDH1A1NAAAMAPT

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-11696959-B2 Nanoparticle-cell construct with platinum anti-cancer agent CITY OF HOPE (US) 2023-07-11 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-11696959-B2 Nanoparticle-cell construct with platinum anti-cancer agent CD47, TP53, CD63 ROCK2 2310/4885ROCK1 1926/4885ALDH1A1 2459/4885

“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.