SCHEMBL8307043

SCHEMBL8307043

CC(C)(C)[Si](C)(C)Oc1cccc(O)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.37
MAPT P10636 2/20 0.37
HPGD P15428 2/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX15 P16050 1/20 0.37
ALOX12 P18054 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TSHR P16473 2/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
ALOX5AP P20292 2/20 0.34
FEN1 P39748 2/20 0.34
CHRM3 P20309 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ADRB1 P08588 1/20 0.32

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
SCHEMBL3440636 0.82 SLC6A2 (0.39) CA1ALOX5APFEN1TRPA1
SCHEMBL8162621 0.82 ALOX5AP (0.35) MAPTKDM4ECA1ALOX5APFEN1
SCHEMBL8958434 0.82 TSHR (0.48) TP53MAPTHPGDALDH1A1KDM4E
SCHEMBL30490016 0.82 TSHR (0.48) TP53MAPTHPGDALDH1A1KDM4E
SCHEMBL15209803 0.81 ALOX5AP (0.35) CA1ALOX5APFEN1MEN1KMT2A
SCHEMBL21751366 0.80 ENPP2 (0.38) ALOX5APFEN1
SCHEMBL10185346 0.79 ALOX5AP (0.34) ALOX5APFEN1
SCHEMBL9614491 0.79 TP53 (0.37) TP53MAPTHPGDALDH1A1KDM4E
SCHEMBL8303433 0.78 MAPK1 (0.40) HPGDALDH1A1KDM4ELMNAALOX15
SCHEMBL8877521 0.76 ALOX5AP (0.37) ALDH1A1TSHRCA1CA2ALOX5AP

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