SCHEMBL29233222

SCHEMBL29233222

NOC(S)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 10/20 0.45
TDO2 P48775 8/20 0.45
DPP4 P27487 2/20 0.43
F2 P00734 1/20 0.43
IDO2 Q6ZQW0 2/20 0.42

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
SCHEMBL10737436 0.83 DPP4 (0.41) IDO1TDO2DPP4F2
SCHEMBL2906245 0.74 KMT2A (0.41) DPP4F2
SCHEMBL98309 0.72 IDO1 (0.74) IDO1TDO2IDO2
SCHEMBL10592791 0.72 SLC6A4 (0.41) DPP4F2
SCHEMBL8775673 0.72 LMNA (0.43)
Hydrochloric Acid SCHEMBL7227619 0.70 IDO1 (0.75) IDO1TDO2IDO2
SCHEMBL1507901 0.70 CYP2D6 (0.48)
SCHEMBL2808637 0.69
Biphenyl SCHEMBL8131645 0.69 EPHX1 (0.43)
SCHEMBL6930355 0.68 IDO1 (0.50) IDO1TDO2DPP4F2IDO2

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
CN-118215676-A Specific conjugation of antibody drug conjugates 杭州多禧生物科技有限公司 2024-06-18 CN claimed