SCHEMBL107304

SCHEMBL107304

CCCCCCCCCc1ccc(O)c(C(C)(C)C)c1I

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.51
TP53 P04637 2/20 0.49
CYP3A4 P08684 2/20 0.49
MEN1 O00255 1/20 0.49
ALOX5 P09917 1/20 0.49
MAPT P10636 1/20 0.49
ALOX15 P16050 1/20 0.49
TSHR P16473 1/20 0.49
HTT P42858 1/20 0.49
KMT2A Q03164 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
BID P55957 3/20 0.40
MCL1 Q07820 3/20 0.40
BCL2L1 Q07817 2/20 0.40
BAK1 Q16611 2/20 0.40
KAT8 Q9H7Z6 2/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
EP300 Q09472 1/20 0.40
KAT2A Q92830 1/20 0.40

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
SCHEMBL7506307 0.94 TYR (0.46) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL27880027 0.85 TYR (0.56) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL11495521 0.85 TYR (0.56) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL816624 0.85 TYR (0.56) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL1861164 0.80 ESR1 (0.39) ALOX15TDP1ESR1TRPV1ALDH1A1
SCHEMBL9074096 0.78 TYR (0.50) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL688631 0.78 BID (0.56) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL1001383 0.76 KLF10 (0.43) TYRALOX15TSHRHTTTDP1
SCHEMBL11352199 0.76 TYR (0.53) TYRTP53CYP3A4MEN1ALOX5
SCHEMBL379742 0.76 TYR (0.57) TYRTP53CYP3A4MEN1ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2424738-A1 TIRE WITH CONTROLLED RESISTANCE TO THE FORMATION OF SURFACE DEFECTS Pirelli Tyre S.P.A. (IT) 2012-03-07 EP disclosed
WO-2010124977-A1 TIRE WITH CONTROLLED RESISTANCE TO THE FORMATION OF SURFACE DEFECTS PIRELLI TYRE S.P.A. (IT) 2010-11-04 WO disclosed
WO-2010108857-A1 STABILISED COMPOSITIONS COMPRISING OLEFINS TOTAL PETROCHEMICALS RESEARCH FELUY (BE) 2010-09-30 WO disclosed