SCHEMBL26414162

SCHEMBL26414162

COC(=O)c1cc(CCc2cc(O[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)c3ccccc3c2)n(C)n1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.33
KDM4E B2RXH2 3/20 0.33
HPGD P15428 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MMP2 P08253 1/20 0.32
MMP13 P45452 1/20 0.32
MMP14 P50281 1/20 0.32
MAPK14 Q16539 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
PDE10A Q9Y233 1/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
PKM P14618 1/20 0.32
KMT2A Q03164 1/20 0.32
PTGER4 P35408 1/20 0.31

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
SCHEMBL26412341 0.91 PLA2G2A (0.38) MEN1KMT2APLA2G2A
SCHEMBL25934603 0.91 PLA2G2A (0.38) ALDH1A1KDM4EHPGDSMN1; SMN2HSD17B10
SCHEMBL26020504 0.86 MEN1 (0.32) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL26412454 0.84 NOTUM (0.33) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL26020297 0.83 KDM4E (0.32) ALDH1A1KDM4EHPGDHSD17B10CA9
SCHEMBL26020415 0.81 PTAFR (0.31) PDE10APTAFR
SCHEMBL26020303 0.81 PTAFR (0.31) PDE10APTAFR
SCHEMBL26020287 0.79 HSD17B10 (0.34) ALDH1A1KDM4EHPGDSMN1; SMN2ADORA3
SCHEMBL26020274 0.76 KDM4E (0.42) ALDH1A1KDM4EHPGDHSD17B10MEN1
SCHEMBL26020277 0.74 TOP2A (0.34) ALDH1A1KDM4EHSD17B10MAPK14PKM

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-20230130109-A1 MACROCYCLIC INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 JANSSEN PHARMACEUTICA NV (BE) 2023-04-27 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-20230130109-A1 MACROCYCLIC INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 MCL1, BCL2L1, BAK1 ALDH1A1 1067/4885KDM4E 1710/4885HPGD 1087/4885

“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.