SCHEMBL18035832

SCHEMBL18035832

CC(C)(O)c1cc(OC(=O)c2cc(C(C)(C)O)ccc2C(C)(C)O)cc(C(C)(C)O)c1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ CES2 O00748 1/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ POLB P06746 2/20 0.35
▸ NR1H4 Q96RI1 4/20 0.34
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ PRSS1 P07477 1/20 0.31
▸ ACR P10323 1/20 0.31
▸ MAPK1 P28482 1/20 0.30

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
SCHEMBL547782 0.78 KMT2A (0.36) MAPTTDP1L3MBTL1POLBNR1H4
SCHEMBL548335 0.78 MAPT (0.50) MAPTTDP1L3MBTL1NR1H4MEN1
SCHEMBL18802919 0.77 MAPT (0.49) MAPTTDP1L3MBTL1NR1H4MEN1
SCHEMBL548289 0.75 MAPT (0.42) MAPTTDP1L3MBTL1POLBNR1H4
SCHEMBL548333 0.74 ESR1 (0.47) MAPTTDP1L3MBTL1KMT2ASMN1; SMN2
SCHEMBL978333 0.73 CES2 (0.35) CES2TDP1
SCHEMBL547102 0.73 TDP1 (0.61) MAPTTDP1L3MBTL1MEN1KMT2A
SCHEMBL548397 0.72 MAPT (0.44) MAPTNPSR1TDP1L3MBTL1POLB
SCHEMBL548764 0.72 ATM (0.41) MAPTTDP1L3MBTL1POLBNR1H4
SCHEMBL547575 0.71 MAPT (0.54) MAPTNPSR1TDP1L3MBTL1NR1H4

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-1739485-B1 RESIST COMPOSITION MITSUBISHI GAS CHEMICAL CO (JP) 2016-08-31 — — EP disclosed
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