SCHEMBL29858616

SCHEMBL29858616

COC(=O)c1c(C)c(-c2ccccc2)cc([N+](=O)[O-])c1OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ MAPT P10636 2/20 0.43
▸ PDCD1 Q15116 6/20 0.42
▸ CD274 Q9NZQ7 6/20 0.42
▸ AR P10275 1/20 0.42
▸ CTSV O60911 2/20 0.41
▸ CTSL P07711 2/20 0.41
▸ PTGES O14684 1/20 0.41
▸ POLB P06746 1/20 0.41

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
SCHEMBL1534099 0.77 MEN1 (0.49) LMNAHPGDMEN1KMT2AMAPT
SCHEMBL114286 0.75 PTGES (0.45) LMNAHPGDMEN1KMT2AMAPT
SCHEMBL13257189 0.75 LMNA (0.61) LMNAHPGDMEN1KMT2AMAPT
SCHEMBL29858779 0.75 LMNA (0.44) LMNAHPGDMEN1KMT2AMAPT
SCHEMBL13851053 0.74 LMNA (0.50) LMNAHPGDMEN1KMT2AMAPT
SCHEMBL10102316 0.74 MAPT (0.45) LMNAHPGDMEN1KMT2AMAPT
SCHEMBL16040428 0.73 MEN1 (0.57) LMNAHPGDMEN1KMT2AMAPT
SCHEMBL31027932 0.73 ERN1 (0.44) LMNAHPGDMEN1KMT2AMAPT
SCHEMBL16061842 0.72 LMNA (0.50) LMNAHPGDMEN1KMT2AMAPT
SCHEMBL1534206 0.72 MEN1 (0.42) MEN1KMT2AMAPTCTSVCTSL

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-12398097-B2 WDR5-MYC inhibitors VANDERBILT UNIVERSITY (US) 2025-08-26 — — US disclosed
US-20220289673-A1 WDR5-MYC INHIBITORS VANDERBILT UNIVERSITY 2022-09-15 — — 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 (2 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-20220289673-A1 WDR5-MYC INHIBITORS MYC, WDR5, MYCBP LMNA 2680/4885HPGD 4416/4885MEN1 1279/4885
US-12398097-B2 WDR5-MYC inhibitors MYC, WDR5, MYCBP LMNA 2680/4885HPGD 4416/4885MEN1 1279/4885

“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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