SCHEMBL8303437

SCHEMBL8303437

C[SiH](C)Oc1ccc(C(=O)O)c(F)c1C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
CYP2C19 P33261 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 3/20 0.34
MAPT P10636 1/20 0.34
MRGPRX4 Q96LA9 2/20 0.34
FABP4 P15090 1/20 0.33
ASPH Q12797 1/20 0.33
KDM8 Q8N371 1/20 0.33
EPHX2 P34913 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
RXRB P28702 1/20 0.31
POLB P06746 1/20 0.31
CFD P00746 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
SCHEMBL9688329 0.83 TDP1 (0.45) KDM4EALDH1A1HPGDHSD17B10TDP1
SCHEMBL17374953 0.83 TDP1 (0.47) KDM4EUSP2ALDH1A1HPGDCYP2C19
SCHEMBL8307045 0.78
SCHEMBL7520417 0.75 TDP1 (0.46) KDM4EALDH1A1HPGDHSD17B10TDP1
SCHEMBL4853079 0.74 KDM4E (0.38) KDM4EUSP2ALDH1A1HPGDCYP2C19
SCHEMBL17374983 0.74 CSNK2A1 (0.44) KDM4EUSP2ALDH1A1HPGDCYP2C19
SCHEMBL753289 0.72 KEAP1 (0.46) KDM4EUSP2ALDH1A1HPGDHSD17B10
SCHEMBL14691383 0.72 TDP1 (0.53) KDM4EUSP2ALDH1A1HPGDCYP2C19
SCHEMBL9487223 0.70 KDM4E (0.35) KDM4EUSP2ALDH1A1HPGDHSD17B10
SCHEMBL4339765 0.70 ALDH1A1 (0.36) KDM4EALDH1A1HSD17B10TDP1NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832078-B1 N-HYDROXYUREAS AS ANTIINFLAMMATORY AGENTS PFIZER (US) 1999-10-20 EP disclosed
US-5814648-A N-hydroxyureas as antiinflammatory agents PFIZER INC. (US) 1998-09-29 US disclosed
EP-0832078-A1 N-HYDROXYUREAS AS ANTIINFLAMMATORY AGENTS PFIZER INC. (US) 1998-04-01 EP disclosed
WO-1996040659-A1 N-HYDROXYUREAS AS ANTIINFLAMMATORY AGENTS PFIZER INC. (US) 1996-12-19 WO disclosed