SCHEMBL14422751

SCHEMBL14422751

C=CC(=O)OCC(C)CS(=O)(=O)Nc1ccc2c(c1)n1n(-c3cc(C(C)(C)C)ccc3O)n21

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 2/20 0.32
▸ NR1H4 Q96RI1 2/20 0.32
▸ PTPN5 P54829 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ KMT2A Q03164 1/20 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
SCHEMBL14422736 0.76 PTPN5 (0.34) EPHX2NR1H4PTPN5ALDH1A1KDM4E
SCHEMBL13400030 0.73 KDM4E (0.34) KDM4EMEN1KMT2A
SCHEMBL13400019 0.69 TGM2 (0.38) —
SCHEMBL813234 0.69 RXFP1 (0.39) NR1H4ALDH1A1KDM4EMEN1HPGD
SCHEMBL13159254 0.69 RXFP1 (0.39) NR1H4ALDH1A1KDM4EMEN1HPGD
SCHEMBL13300782 0.68 MEN1 (0.38) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL13400035 0.68 MDH1 (0.37) MEN1KMT2A
SCHEMBL13300805 0.68 ALDH1A1 (0.34) ALDH1A1MEN1HPGDKMT2A
SCHEMBL13400033 0.67 MDH1 (0.38) KDM4E
SCHEMBL13300774 0.66 KDM4E (0.39) ALDH1A1KDM4EMEN1HPGDKMT2A

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
US-20070218218-A1 Cellulose acylate optical film, producing method thereof, polarizing plate and liquid crystal display using the same KONICA MINOLTA OPTO, INC. (JP) 2007-09-20 — — US disclosed
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