SCHEMBL27554383

SCHEMBL27554383

Cc1cc2c(cc1C)C(=O)C=C2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 1/20 0.39
PIM1 P11309 1/20 0.38
IDO1 P14902 3/20 0.36
CDC25B P30305 2/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
AKT1 P31749 1/20 0.36
SNCA P37840 1/20 0.36
MAP2K1 Q02750 1/20 0.36
PIN1 Q13526 1/20 0.36
EHMT2 Q96KQ7 1/20 0.36
NSD1 Q96L73 1/20 0.36
EHMT1 Q9H9B1 1/20 0.36
PTPRC P08575 4/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
BCHE P06276 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL3197749 0.84 PIM1 (0.48) S100A4PIM1IDO1CDC25BMAOA
SCHEMBL11858854 0.71 S100A4 (0.50) S100A4PIM1IDO1CDC25BMAOA
SCHEMBL13967835 0.71 CA1 (0.45) S100A4PIM1IDO1CDC25BMAOA
SCHEMBL30949457 0.70 AHR (0.39) S100A4IDO1CDC25BMAOAMAOB
SCHEMBL28585870 0.70 PTPRC (0.42) PIM1IDO1CDC25BMAOAMAOB
SCHEMBL31050180 0.70 IDO1 (0.36) S100A4IDO1CDC25BMAOAMAOB
SCHEMBL29172186 0.70 IDO1 (0.36) S100A4IDO1CDC25BMAOAMAOB
SCHEMBL1889820 0.70 CA1 (0.50) PTPRCKDM4EMEN1ALDH1A1MAPT
SCHEMBL23937872 0.69 S100A4 (0.42) S100A4PIM1IDO1CDC25BMAOA
SCHEMBL18666618 0.68 GRIN2D (0.43) S100A4PIM1IDO1CDC25BMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110483670-A The method of metallocene complex and production olefin polymer JAPAN POLYPROPYLENE CORP 2019-11-22 CN disclosed
CN-106132975-B Metallocene complex and process for producing olefin polymer 日本聚丙烯株式会社 2019-11-08 CN disclosed
CN-1921841-A Amines and amides for the treatment of diseases JOLLA PHARMA (US) 2007-02-28 CN disclosed
CN-1198835-C Bridged metallocene complex for (CO) polymerization of olefins ENICHEM SPA (IT) 2005-04-27 CN disclosed
CN-1239098-A Bridged metallocene complex for (CO) polymerization of olefins ENICHEM SPA (IT) 1999-12-22 CN disclosed