SCHEMBL26076850

SCHEMBL26076850

COc1cc2c(cc1Cc1cccc(Cl)c1F)c(=O)c(C)cn2[C@@H](CO)C(C)C

nearest known ligand 0.80

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 1/20 0.80
▸ EGFR P00533 10/20 0.35
▸ PLA2G4A P47712 3/20 0.35
▸ GAA P10253 2/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ MAPT P10636 1/20 0.33

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
SCHEMBL11948689 0.89 METTL3 (0.64) METTL3MAPT
Elvitegravir SCHEMBL726252 0.89 METTL3 (1.00) METTL3EGFRPLA2G4AGAATP53
Elvitegravir SCHEMBL29623981 0.89 METTL3 (1.00) METTL3EGFRPLA2G4AGAATP53
Elvitegravir SCHEMBL726251 0.89 METTL3 (1.00) METTL3EGFRPLA2G4AGAATP53
SCHEMBL1104875 0.89 METTL3 (0.88) METTL3EGFRPLA2G4AGAAMAPT
Elvitegravir SCHEMBL13225651 0.89 METTL3 (1.00) METTL3EGFRPLA2G4AGAATP53
SCHEMBL19829420 0.89 METTL3 (0.88) METTL3EGFRPLA2G4AGAAMAPT
SCHEMBL13862207 0.89 METTL3 (0.64) METTL3EGFRPLA2G4AGAACNR2
SCHEMBL13693054 0.88 METTL3 (0.86) METTL3EGFRPLA2G4AGAATP53
SCHEMBL13942147 0.88 METTL3 (0.86) METTL3EGFRPLA2G4AGAATP53

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
WO-2023183472-A1 ANTIVIRAL PRODRUGS AND USE THEREOF BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 2023-09-28 — — WO disclosed
Send feedback