SCHEMBL4640898

SCHEMBL4640898

COc1ccc(CC(C)C(C)Cc2ccc(OC)c(OC)c2)cc1O

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 6/20 0.90
ALOX12 P18054 6/20 0.90
FOS P01100 2/20 0.73
TTR P02766 2/20 0.73
JUN P05412 2/20 0.73
NR3C1 P04150 2/20 0.73
HSD17B1 P14061 2/20 0.73
HSD17B2 P37059 2/20 0.73
CYP3A4 P08684 3/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
KDM4E B2RXH2 2/20 0.58
ALDH1A1 P00352 2/20 0.58
ESR1 P03372 2/20 0.58
TP53 P04637 2/20 0.58
HPGD P15428 2/20 0.58
MAPK1 P28482 2/20 0.58
RECQL P46063 2/20 0.58
HIF1A Q16665 2/20 0.58
HSD17B10 Q99714 2/20 0.58

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
Dimethylnordihydroguarierate Acid SCHEMBL22039401 0.95 ALOX15 (1.00) ALOX15ALOX12FOSTTRJUN
SCHEMBL22040032 0.92 ALOX15 (1.00) ALOX15ALOX12FOSTTRJUN
SCHEMBL2390 0.90 FOS (0.90) ALOX15ALOX12FOSTTRJUN
SCHEMBL16917560 0.90 FOS (0.90) ALOX15ALOX12FOSTTRJUN
SCHEMBL3160 0.90 ALOX15 (0.90) ALOX15ALOX12FOSTTRJUN
SCHEMBL31237435 0.90 FOS (0.90) ALOX15ALOX12FOSTTRJUN
Terameprocol SCHEMBL2356280 0.89 ALOX15 (0.77) ALOX15ALOX12FOSTTRJUN
Terameprocol SCHEMBL29794162 0.89 ALOX15 (0.77) ALOX15ALOX12FOSTTRJUN
Terameprocol SCHEMBL194588 0.89 ALOX15 (0.77) ALOX15ALOX12FOSTTRJUN
Terameprocol SCHEMBL10060164 0.89 ALOX15 (0.77) ALOX15ALOX12FOSTTRJUN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE40246-E1 Method for the suppression of viral growth JOHN HOPKINS UNIVERSITY (US) 2008-04-15 US claimed
EP-0783474-B1 COMPOUNDS FOR THE SUPPRESSION OF HIV TAT TRANSACTIVATION UNIV JOHNS HOPKINS (US) 2008-08-06 EP disclosed
US-RE40246-E1 Method for the suppression of viral growth JOHN HOPKINS UNIVERSITY (US) 2008-04-15 US disclosed
US-RE40246-E1 Method for the suppression of viral growth JOHN HOPKINS UNIVERSITY (US) 2008-04-15 US disclosed
US-6365787-B1 CREOSOTE BUSH LARREA TRIDENTATA EXTRACTS OF 1,4-BIS-(3,4-DIHYDROXY-PHENYL)-2,3-DIMETHYLBUTANE DERIVATIVES THE JOHNS HOPKINS UNIVERSITY 2002-04-02 US disclosed
US-6291524-B1 HYDROXY-, METHOXY- AND ACETOXY-DERIVATIVES OF 2,3-DIMETHYL-1,4-DIPHENYLBUTANE JOHNS HOPKINS UNIVERSITY 2001-09-18 US disclosed
US-5663209-A Compounds for the suppression of HIV Tat transactivation THE JOHNS HOPKINS UNIVERSITY (US) 1997-09-02 US disclosed
WO-1996010549-A9 COMPOUNDS FOR THE SUPPRESSION OF HIV TAT TRANSACTIVATION 1996-06-06 WO disclosed