SCHEMBL23099412

SCHEMBL23099412

CCc1nc2ncc(COC)cn2c1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
ALKBH1 Q13686 2/20 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
SCHEMBL23099413 0.86 KDM4E (0.43) L3MBTL1LMNA
SCHEMBL26527717 0.82 ALKBH1 (0.36) LMNAALKBH1
SCHEMBL23099556 0.80 KDM4E (0.33) TP53
SCHEMBL23099456 0.79 AGBL2 (0.34)
SCHEMBL23099492 0.79 GABRP (0.32)
SCHEMBL23099631 0.78 CYP2C9 (0.39) POLBTDP1L3MBTL1LMNATP53
SCHEMBL23099441 0.78 ALKBH1 (0.38) POLBLMNAALKBH1
SCHEMBL24689674 0.74 CYP2C9 (0.35) TDP1L3MBTL1
SCHEMBL24689506 0.74 GABRP (0.34) LMNATP53
SCHEMBL26527736 0.71 KDM4E (0.40) L3MBTL1

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-2021048342-A1 ANTIBACTERIAL COMPOUNDS Janssen Sciences Ireland Unlimited Company (IE) 2021-03-18 WO disclosed