SCHEMBL24528583

SCHEMBL24528583

CN(C)CCC/N=C/c1ccc(-c2nc(Cl)nc3c2ccn3-c2ccccc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.33
LMNA P02545 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
PSMD14 O00487 1/20 0.31
NUDT1 P36639 1/20 0.30
MAOB P27338 1/20 0.30
POLB P06746 1/20 0.30
ATM Q13315 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
SCHEMBL29680660 1.00 KDM4E (0.38) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL24528715 0.96 KDM4E (0.38) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL29680698 0.96 KDM4E (0.38) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL29680746 0.90 KDM4E (0.37) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL24528512 0.90 KDM4E (0.37) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL24528636 0.89 NUDT1 (0.41) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL24528695 0.87 KDM4E (0.34) KDM4EALDH1A1LMNANUDT1MAOB
SCHEMBL29680601 0.86 KDM4E (0.36) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL24528699 0.86 KDM4E (0.36) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL24528677 0.86 KDM4E (0.34) KDM4EALDH1A1LMNANUDT1MAOB

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-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