SCHEMBL30656018

SCHEMBL30656018

Cc1ncsc1COc1ccc2sc(C)c(C(=O)NC3(CO)CCOCC3)c2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 3/20 0.38
MMP3 P08254 2/20 0.38
MMP7 P09237 2/20 0.38
ADAMTS4 O75173 1/20 0.38
ADAMTS1 Q9UHI8 1/20 0.38
ADAMTS5 Q9UNA0 1/20 0.38
BTK Q06187 1/20 0.36
MMP2 P08253 1/20 0.36
MMP12 P39900 1/20 0.36
MMP13 P45452 1/20 0.36
CD274 Q9NZQ7 1/20 0.33
CNR2 P34972 2/20 0.33
CNR1 P21554 1/20 0.33
DGAT2 Q96PD7 3/20 0.32
ANO1 Q5XXA6 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL30656026 0.94 SCN9A (0.33) ADAM17MMP3MMP7ADAMTS4ADAMTS1
SCHEMBL30655952 0.92 ADAM17 (0.32) ADAM17MMP3MMP7ADAMTS4ADAMTS1
SCHEMBL30656350 0.92 ADAM17 (0.34) ADAM17MMP3MMP7ADAMTS4ADAMTS1
SCHEMBL30656118 0.88 CNR2 (0.37) ADAM17MMP3MMP7ADAMTS4ADAMTS1
SCHEMBL24484786 0.86 GAA (0.42) ADAM17MMP3MMP7ADAMTS4ADAMTS1
SCHEMBL30656102 0.85 MMP3 (0.38) ADAM17MMP3MMP7ADAMTS4ADAMTS1
SCHEMBL30656232 0.84 KDM4E (0.43) ADAM17MMP3MMP7ADAMTS4ADAMTS1
SCHEMBL24484365 0.84 MMP3 (0.38) ADAM17MMP3MMP7ADAMTS4ADAMTS1
SCHEMBL30656223 0.83 BTK (0.42) ADAM17MMP3MMP7ADAMTS4ADAMTS1
SCHEMBL24484863 0.83 MMP3 (0.37) ADAM17MMP3MMP7ADAMTS4ADAMTS1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4532013-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS Katholieke Universiteit Leuven KU Leuven Research & Development (BE) 2025-04-09 EP claimed
WO-2023227697-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO claimed
EP-4532013-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS Katholieke Universiteit Leuven KU Leuven Research & Development (BE) 2025-04-09 EP disclosed
WO-2023227697-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed