SCHEMBL23615513

SCHEMBL23615513

Cc1ccc2c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc3n(-c3ccc(-c4cccc(-n5c6ccccc6c6cc(-c7ccc8c(c7)c7cccc(C)c7n8-c7ccccc7)ccc65)c4)cc3)c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALKBH5 Q6P6C2 1/20 0.37
FTO Q9C0B1 1/20 0.37
TSPO P30536 2/20 0.35
AKR1C4 P17516 1/20 0.35
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
AKR1C1 Q04828 1/20 0.35
GAA P10253 2/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 2/20 0.34
MAPT P10636 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
PTGER4 P35408 1/20 0.34
HDAC4 P56524 1/20 0.33
CYP1A2 P05177 1/20 0.31
KHK P50053 1/20 0.31

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
SCHEMBL25925512 0.92 L3MBTL1 (0.46) KDM4EATML3MBTL1ALKBH5FTO
SCHEMBL26226216 0.92 L3MBTL1 (0.46) KDM4EATML3MBTL1TSPOAKR1C4
SCHEMBL17178943 0.91 L3MBTL1 (0.47) KDM4EATML3MBTL1TSPOAKR1C4
SCHEMBL17178937 0.91 L3MBTL1 (0.47) KDM4EATML3MBTL1TSPOAKR1C4
SCHEMBL17032731 0.91 L3MBTL1 (0.47) KDM4EATML3MBTL1TSPOAKR1C4
SCHEMBL17032730 0.90 L3MBTL1 (0.46) KDM4EATML3MBTL1TSPOAKR1C4
SCHEMBL17032733 0.90 L3MBTL1 (0.46) KDM4EATML3MBTL1TSPOAKR1C4
SCHEMBL18779606 0.90 ATM (0.45) KDM4EATML3MBTL1TSPOAKR1C4
SCHEMBL22598472 0.90 L3MBTL1 (0.49) KDM4EATML3MBTL1TSPOAKR1C4
SCHEMBL20878493 0.89 L3MBTL1 (0.47) KDM4EATML3MBTL1ALKBH5FTO

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
EP-3257093-B1 ELECTRONIC DEVICE CONTAINING CYCLIC LACTAMS MERCK PATENT GMBH (DE) 2021-07-07 EP disclosed