SCHEMBL30656111

SCHEMBL30656111

Cc1sc2ccc(OCc3ccccc3F)cc2c1C(=O)NC1(C(N)=O)CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.46
MMP13 P45452 1/20 0.46
PARP15 Q460N3 3/20 0.40
PARP10 Q53GL7 3/20 0.40
MAOB P27338 4/20 0.39
PARP14 Q460N5 1/20 0.39
SCN3A Q9NY46 5/20 0.38
SCN9A Q15858 1/20 0.37
KCNH2 Q12809 3/20 0.37
ADAMTS4 O75173 1/20 0.36
MMP3 P08254 1/20 0.36
MMP7 P09237 1/20 0.36
ADAM17 P78536 1/20 0.36
ADAMTS1 Q9UHI8 1/20 0.36
ADAMTS5 Q9UNA0 1/20 0.36
F9 P00740 1/20 0.36
CNR2 P34972 1/20 0.35

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
SCHEMBL30656050 0.92 PARP15 (0.41) MMP1MMP13PARP15PARP10MAOB
SCHEMBL30656068 0.88 MMP13 (0.42) MMP1MMP13PARP15PARP10MAOB
SCHEMBL30656215 0.85 MAPK14 (0.39) PARP10CNR2
SCHEMBL30656207 0.83 CNR2 (0.38) MMP1MMP13ADAMTS4MMP3MMP7
SCHEMBL30656182 0.83 MAOB (0.40) MMP1MMP13PARP15PARP10MAOB
SCHEMBL30656149 0.83 PARP15 (0.41) MMP1MMP13PARP15PARP10MAOB
SCHEMBL30656118 0.82 CNR2 (0.37) MMP1MMP13PARP15PARP10ADAMTS4
SCHEMBL30656091 0.81 PARP15 (0.39) MMP1PARP15PARP10MAOBPARP14
SCHEMBL24471031 0.80 SLC26A4 (0.49) MMP1MMP13PARP15PARP10
SCHEMBL30656334 0.80 CYP4F2 (0.40) MMP1MMP13ADAMTS4MMP3MMP7

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