SCHEMBL13382708

SCHEMBL13382708

CC(C=CC(C)(C)C1=C(O)c2ccccc2C1=O)C=C1C(=O)c2ccccc2C1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.43
▸ MAPK1 P28482 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ APAF1 O14727 1/20 0.36
▸ TDP2 O95551 1/20 0.36
▸ NPC1 O15118 5/20 0.35
▸ RAB9A P51151 5/20 0.35
▸ MAPT P10636 7/20 0.34
▸ ALDH1A1 P00352 6/20 0.34
▸ SMN1; SMN2 Q16637 5/20 0.34
▸ P2RX7 Q99572 3/20 0.34
▸ HTT P42858 2/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ MEN1 O00255 5/20 0.34
▸ KMT2A Q03164 5/20 0.34
▸ PKM P14618 4/20 0.34
▸ LMNA P02545 3/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ CDC25B P30305 2/20 0.34
▸ TP53 P04637 1/20 0.34

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
SCHEMBL12715781 0.80 DHODH (0.41) DHODHMAPK1TSHRAPAF1TDP2
SCHEMBL29355977 0.75 DHODH (0.51) DHODHMAPK1TSHRAPAF1TDP2
SCHEMBL4784189 0.73 APAF1 (0.50) DHODHMAPK1TSHRAPAF1TDP2
SCHEMBL1100511 0.65 MAPT (0.54) DHODHMAPK1APAF1TDP2NPC1
SCHEMBL8459324 0.64 APAF1 (0.60) DHODHMAPK1TSHRAPAF1TDP2
SCHEMBL18327998 0.63 MAPT (0.52) MAPK1APAF1TDP2NPC1RAB9A
SCHEMBL8446033 0.62 APEX1 (0.38) DHODHMAPK1TSHRAPAF1TDP2
SCHEMBL29359488 0.62 APEX1 (0.38) DHODHMAPK1TSHRAPAF1TDP2
SCHEMBL22349000 0.61 S100A4 (0.44) MAPK1APAF1TDP2NPC1RAB9A
SCHEMBL8459098 0.60 MAPT (0.55) DHODHMAPK1TDP2NPC1RAB9A

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
EP-2180467-A1 Photon-mode recording method Fujifilm Corporation (JP) 2010-04-28 — — EP disclosed
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