SCHEMBL30940239

SCHEMBL30940239

O=Cc1sccc1-c1ccc(N(c2ccc(-c3ccsc3C=O)cc2)c2ccc(-c3ccsc3C=O)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.41
PTGS1 P23219 3/20 0.39
PRKDC P78527 1/20 0.33
BCAT2 O15382 1/20 0.33
PTGS2 P35354 2/20 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
SCHEMBL29749053 0.93 APP (0.50) APPPTGS1PRKDCBCAT2PTGS2
SCHEMBL30535946 0.92 PTGS2 (0.40) APPPTGS1PRKDCPTGS2
SCHEMBL1829790 0.79 PTGS2 (0.45) APPPTGS1PRKDCPTGS2
SCHEMBL3722270 0.79 PTGS1 (0.60) PTGS1PTGS2
SCHEMBL6822436 0.79 PTGS1 (0.40) PTGS1PRKDCPTGS2
SCHEMBL16049525 0.79 PTGS1 (0.40) PTGS1PRKDCPTGS2
SCHEMBL13766280 0.79 EDNRB (0.38) PTGS1PRKDC
SCHEMBL2461016 0.79 BCAT2 (0.47) PTGS1PRKDCBCAT2PTGS2
SCHEMBL9696347 0.77 PRKDC (0.41) PTGS1PRKDC
SCHEMBL3975326 0.76 PTGS1 (0.37) PTGS1PRKDCBCAT2

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-118359779-A Sp derived from carbonyl monomer2Carbon conjugated polymer and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2024-07-19 CN disclosed