SCHEMBL28019595

SCHEMBL28019595

NC(C(=O)O)C(=O)c1c(O)c2cc(Cl)cc(-c3ccccc3)c2sc1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
FABP3 P05413 2/20 0.31
FABP4 P15090 2/20 0.31
FABP5 Q01469 1/20 0.31
MAP2 P11137 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C8 P10632 1/20 0.31
CYP2C9 P11712 1/20 0.31
DHODH Q02127 1/20 0.31
CHEK1 O14757 1/20 0.31
WEE1 P30291 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
SCHEMBL28019086 0.83 ALDH1A1 (0.35) HDAC4HDAC2HDAC8HDAC6KDM4E
SCHEMBL2472669 0.77 EGLN1 (0.43)
SCHEMBL28019092 0.75 STIM1 (0.38) HDAC4HDAC2HDAC8HDAC6KDM4E
SCHEMBL28019081 0.74 RXRA (0.34) RXFP1
SCHEMBL28019089 0.68 HPGD (0.36) ESR1CYP3A4
SCHEMBL28019080 0.68 ESR1 (0.37) ESR1CYP3A4DHODH
SCHEMBL29993952 0.63 TNKS (0.48) KDM4EMEN1KMT2ARXFP1CHEK1
SCHEMBL15509480 0.62 BACE1 (0.54) HDAC4HDAC2HDAC8HDAC6ESR2
SCHEMBL2470691 0.61 EGLN1 (0.47)
SCHEMBL29992854 0.61 TNKS (0.46) KDM4EMEN1KMT2ARXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105037323-A Thiochromene derivatives as HIF hydroxylase inhibitors FIBROGEN INC 2015-11-11 CN disclosed
CN-102272117-B Benzothiopyran derivatives as HIF hydroxylase inhibitors FIBROGEN INC 2015-06-17 CN disclosed