SCHEMBL24916118

SCHEMBL24916118

COC(=O)c1cc(Br)c2cc(OC)ccc2n1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 8/20 0.53
▸ BACE1 P56817 1/20 0.49
▸ KDM4E B2RXH2 4/20 0.49
▸ HSD17B10 Q99714 3/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ HPGD P15428 3/20 0.49
▸ POLB P06746 1/20 0.49
▸ LMNA P02545 2/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ CTSL P07711 1/20 0.46
▸ CTSB P07858 1/20 0.46
▸ MAPK1 P28482 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ ATM Q13315 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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
SCHEMBL29923473 1.00 PLA2G2A (0.53) PLA2G2ABACE1KDM4EHSD17B10ALDH1A1
SCHEMBL16832843 0.84 PLA2G2A (0.69) PLA2G2ABACE1KDM4EHSD17B10ALDH1A1
SCHEMBL2910558 0.84 PLA2G2A (0.54) PLA2G2ABACE1KDM4EHSD17B10ALDH1A1
SCHEMBL28130384 0.83 KDM4E (0.68) PLA2G2ABACE1KDM4EHSD17B10ALDH1A1
SCHEMBL1694287 0.81 KDM4E (0.52) KDM4EHSD17B10ALDH1A1HPGDPOLB
SCHEMBL32681649 0.81 KDM4E (0.52) KDM4EHSD17B10ALDH1A1HPGDPOLB
SCHEMBL28559497 0.80 PLA2G2A (0.62) PLA2G2AKDM4EALDH1A1NPSR1MEN1
SCHEMBL13234529 0.79 KCNH2 (0.51) PLA2G2ABACE1KDM4EHSD17B10ALDH1A1
SCHEMBL28491584 0.78 GRM2 (0.57) PLA2G2ABACE1KDM4EHSD17B10ALDH1A1
SCHEMBL28130383 0.77 PLA2G2A (0.67) PLA2G2AKDM4EHSD17B10ALDH1A1HPGD

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
EP-4055013-B1 WDR5 INHIBITORS AND MODULATORS UNIV VANDERBILT (US) 2024-03-20 — — EP disclosed
US-20230026466-A1 WDR5 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY 2023-01-26 — — 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-20230026466-A1 WDR5 INHIBITORS AND MODULATORS WDR5, WDR1, WDR3 PLA2G2A 3521/4885BACE1 4107/4885KDM4E 105/4885

“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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