SCHEMBL4625923

SCHEMBL4625923

Cc1cc(C)c(C(=O)P(C(=O)c2c(C)cc(C)cc2C)c2ccc(OC(C)C)cc2OC(C)C)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.40
ALDH1A1 P00352 4/20 0.38
MAPT P10636 4/20 0.38
GAA P10253 1/20 0.38
TSPO P30536 1/20 0.37
MCL1 Q07820 2/20 0.37
KMT2A Q03164 2/20 0.36
PARP10 Q53GL7 1/20 0.36
BRD4 O60885 1/20 0.35
BRPF1 P55201 1/20 0.35
HPGD P15428 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HSD17B10 Q99714 1/20 0.35
IRAK4 Q9NWZ3 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
POLB P06746 1/20 0.34
MCOLN3 Q8TDD5 1/20 0.34
NLRP1 Q9C000 1/20 0.34
NPY1R P25929 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
SCHEMBL4625910 0.85 HDAC1 (0.35) ALDH1A1MAPTKMT2AHPGDNPSR1
SCHEMBL19180233 0.81 NPC1 (0.43) ALDH1A1MAPTGAAKMT2AHPGD
SCHEMBL4629635 0.80 FOS (0.37) ALDH1A1MAPTGAAMCL1HPGD
SCHEMBL4625913 0.78 MAPK1 (0.42) ALDH1A1GAAHSD17B10NPSR1TDP1
SCHEMBL155286 0.76 IRAK4 (0.43) FFAR4ALDH1A1KMT2ABRPF1HPGD
SCHEMBL4624419 0.74 ALDH1A1 (0.40) FFAR4ALDH1A1GAAKMT2AHPGD
SCHEMBL29424084 0.74 ITGB1 (0.47)
SCHEMBL1853827 0.74 ITGB1 (0.47)
SCHEMBL4625095 0.73 ITGB1 (0.46)
SCHEMBL4625104 0.73 ITGB1 (0.46)

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-1215044-B1 A laser engravable flexographic printing element and a method for forming a printing plate from the element DU PONT (US) 2008-05-21 EP claimed