SCHEMBL29680872

SCHEMBL29680872

CC(CCN=Cc1ccc(-c2nc(-c3ccc(C=NCCC(C)N(C)C)cc3)c3ccn(-c4ccccc4)c3n2)cc1)N(C)C

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL29680999 0.97 MGLL (0.30)
SCHEMBL29680952 0.91
SCHEMBL29681233 0.89
SCHEMBL29680894 0.87
SCHEMBL29681070 0.86
SCHEMBL24528512 0.85 KDM4E (0.37) KDM4E
SCHEMBL29680746 0.85 KDM4E (0.37) KDM4E
SCHEMBL24528695 0.84 KDM4E (0.34) KDM4E
SCHEMBL24528677 0.83 KDM4E (0.34) KDM4E
SCHEMBL29680878 0.83 RAB9A (0.33) KDM4ENPSR1

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-4263539-A1 6-6 OR 5-6 FUSED BICYCLIC COMPOUNDS COMPRISING A PYRI(MI)DINE RING USEFUL IN THE TREATMENT OF INFECTIOUS DISEASES INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE - INSERM (FR) 2023-10-25 EP disclosed
WO-2022129376-A1 6-6 OR 5-6 FUSED BICYCLIC COMPOUNDS COMPRISING A PYRI(MI)DINE RING USEFUL IN THE|TREATMENT OF INFECTIOUS DISEASES INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2022-06-23 WO disclosed