SCHEMBL9449454

SCHEMBL9449454

CC(=O)c1ccc2c(c1)SNC(=O)C2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.49
▸ NPC1 O15118 3/20 0.49
▸ RAB9A P51151 3/20 0.49
▸ TDP2 O95551 3/20 0.43
▸ HSD17B1 P14061 1/20 0.43
▸ HPGD P15428 1/20 0.38
▸ KMT2A Q03164 3/20 0.37
▸ GAA P10253 2/20 0.37
▸ NOX1 Q9Y5S8 2/20 0.37
▸ SLC2A1 P11166 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ CYBB P04839 1/20 0.37
▸ APP P05067 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ SNCA P37840 1/20 0.37
▸ NOX3 Q9HBY0 1/20 0.37
▸ NOX4 Q9NPH5 1/20 0.37
▸ CRBN Q96SW2 1/20 0.37
▸ PGR P06401 1/20 0.35
▸ S100A4 P26447 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
SCHEMBL27528567 0.84 ATM (0.40) MAPTTDP2HPGDKMT2AGAA
SCHEMBL9449446 0.81 PTPN1 (0.40) TDP2
SCHEMBL27362455 0.77 TDP2 (0.34) TDP2CRBN
SCHEMBL8923640 0.76 TSHR (0.35) NPC1TDP2KMT2AMEN1
SCHEMBL27357288 0.76 TDP2 (0.30) TDP2CRBN
SCHEMBL14521036 0.72 CRBN (0.60) MAPTNPC1RAB9ATDP2HSD17B1
SCHEMBL21135535 0.70 MAPT (0.54) MAPTNPC1RAB9AHSD17B1HPGD
SCHEMBL688076 0.69 EPHX2 (0.56) MAPTNPC1RAB9AKMT2AGAA
SCHEMBL7349547 0.69 MAPT (0.49) MAPTNPC1RAB9ATDP2HSD17B1
SCHEMBL74499 0.69 AHR (0.45) MAPTNPC1TDP2HPGDKMT2A

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
US-5234924-A Hypotensive agents ADIR ET COMPAGNIE (FR) 1993-08-10 — — US disclosed
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