SCHEMBL24930809

SCHEMBL24930809

O=C(O)c1nc(-n2c3ccccc3c3ccccc32)nc(-n2c3ccccc3c3ccccc32)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
POLB P06746 1/20 0.44
KDM4E B2RXH2 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
ATM Q13315 1/20 0.44
FABP4 P15090 3/20 0.40
FABP5 Q01469 3/20 0.40
FABP3 P05413 2/20 0.40
P2RX4 Q99571 1/20 0.39
RORC P51449 1/20 0.38
FOLH1 Q04609 1/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 1/20 0.38
PDE10A Q9Y233 1/20 0.38
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL132065 0.87 ALDH1A1 (0.47) ALDH1A1POLBKDM4EL3MBTL1ATM
SCHEMBL1303181 0.82 KDM4E (0.54) ALDH1A1POLBKDM4EL3MBTL1ATM
SCHEMBL29389255 0.82 KDM4E (0.54) ALDH1A1POLBKDM4EL3MBTL1ATM
SCHEMBL24609436 0.78 KDM4E (0.50) ALDH1A1POLBKDM4EL3MBTL1ATM
SCHEMBL17486142 0.77 KDM4E (0.45) ALDH1A1POLBKDM4EL3MBTL1ATM
SCHEMBL20252385 0.76 POLB (0.42) ALDH1A1POLBL3MBTL1LMNAMAPT
SCHEMBL11892559 0.76 L3MBTL1 (0.48) ALDH1A1POLBKDM4EL3MBTL1ATM
SCHEMBL3297518 0.75 P2RX4 (0.48) ALDH1A1POLBKDM4EL3MBTL1ATM
SCHEMBL24930808 0.74 KDM4E (0.52) ALDH1A1POLBKDM4EL3MBTL1ATM
SCHEMBL24930901 0.74 ALDH1A1 (0.49) ALDH1A1POLBKDM4EL3MBTL1ATM

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
US-20230036119-A1 QUANTUM DOTS WITH DONOR-ACCEPTOR LIGANDS NANOSYS, INC. 2023-02-02 US disclosed