SCHEMBL31424869

SCHEMBL31424869

Cc1nc2c(Oc3ccccc3)cc(CO)cc2[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 2/20 0.42
TTR P02766 1/20 0.41
GRIN1 Q05586 6/20 0.38
GRIN2B Q13224 6/20 0.38
POLB P06746 1/20 0.38
ALOX15 P16050 1/20 0.38
NTRK1 P04629 1/20 0.38
IGF1R P08069 1/20 0.38
FGFR1 P11362 1/20 0.38
NTRK2 Q16620 1/20 0.38
BRD4 O60885 1/20 0.38
DHODH Q02127 2/20 0.38
LTA4H P09960 1/20 0.37
P2RX3 P56373 1/20 0.36
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
MMP13 P45452 1/20 0.36

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
SCHEMBL31424732 0.89 PARP1 (0.36) RHEBBRD4DHODH
SCHEMBL31424768 0.88 BRD4 (0.44) RHEBBRD4
SCHEMBL31424682 0.88 GRIN1 (0.37) RHEBTTRGRIN1GRIN2BPOLB
SCHEMBL31424693 0.88 GRIN1 (0.37) RHEBTTRGRIN1GRIN2BPOLB
SCHEMBL31424599 0.85 CYP11B1 (0.42) GRIN1GRIN2BDHODH
SCHEMBL31424741 0.85 BRD4 (0.40) BRD4
SCHEMBL31424666 0.81 SLC6A4 (0.38) GRIN1GRIN2BPOLBALOX15NTRK1
SCHEMBL31424567 0.80 HSD17B10 (0.38) ALOX15
SCHEMBL31424804 0.80 DHODH (0.41) GRIN1GRIN2BPOLBDHODHGRIN2D
SCHEMBL31424608 0.79 PARP1 (0.37) POLBBRD4P2RX3

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
CN-120020129-A Substituted nitrogen-containing bicyclic compounds and uses thereof 广东东阳光药业股份有限公司 2025-05-20 CN disclosed
CN-119431314-A Substituted nitrogen-containing bicyclic compounds and uses thereof 广东东阳光药业股份有限公司 2025-02-14 CN disclosed