SCHEMBL29601828

SCHEMBL29601828

CCOC(=O)c1[nH]c2c(B3OC(C)(C)C(C)(C)O3)c(C)ccc2c1[C@H](C)CCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 1/20 0.31
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
MDM2 Q00987 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL19635267 1.00 UCHL1 (0.31) UCHL1PRMT5WDR77MDM2KDM4E
SCHEMBL19615953 0.91 PRMT5 (0.32) PRMT5WDR77KDM4EALDH1A1HPGD
SCHEMBL29601766 0.86 KDM4E (0.33) UCHL1KDM4EALDH1A1HPGD
SCHEMBL19635012 0.86 KDM4E (0.33) UCHL1KDM4EALDH1A1HPGD
SCHEMBL21802166 0.84 HTR6 (0.35) UCHL1PRMT5WDR77ALDH1A1
SCHEMBL29601778 0.80 MCL1 (0.39) KDM4EALDH1A1HPGD
SCHEMBL19635268 0.80 MCL1 (0.39) KDM4EALDH1A1HPGD
SCHEMBL22437338 0.76 HTR6 (0.35) UCHL1ALDH1A1
SCHEMBL22436710 0.76 HTR6 (0.34) UCHL1ALDH1A1
SCHEMBL21802248 0.75 MCL1 (0.30) KDM4EALDH1A1HPGD

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-11492358-B1 Macrocyclic indole derivatives THE BROAD INSTITUTE, INC. (US) 2022-11-08 US disclosed
EP-3458459-B1 MACROCYCLIC INDOLE DERIVATIVES BAYER AG (DE) 2022-04-27 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-11492358-B1 Macrocyclic indole derivatives CCND2, CCNT2, IDO1 UCHL1 3420/4885PRMT5 168/4885WDR77 2941/4885

“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.