SCHEMBL6655041

SCHEMBL6655041

CCCCCCc1ccc2cc3cc4cc5ccccc5cc4cc3cc2c1CCCCCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
TYR P14679 2/20 0.44
CYP3A4 P08684 2/20 0.44
TSHR P16473 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TP53 P04637 1/20 0.44
ALOX5 P09917 1/20 0.44
ALOX15 P16050 1/20 0.44
HTT P42858 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
USP2 O75604 1/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL6656073 1.00 MAPT (0.44) MAPTTYRCYP3A4TSHRMEN1
SCHEMBL6659847 1.00 MAPT (0.44) MAPTTYRCYP3A4TSHRMEN1
SCHEMBL28162721 1.00 MAPT (0.44) MAPTTYRCYP3A4TSHRMEN1
SCHEMBL11379723 0.98 MAPT (0.45) MAPTTYRCYP3A4TSHRMEN1
SCHEMBL1023150 0.98 TLR8 (0.43) MAPTTYRCYP3A4TSHRMEN1
SCHEMBL6892060 0.98 MAPT (0.45) MAPTTYRCYP3A4TSHRMEN1
SCHEMBL10452003 0.98 MAPT (0.45) MAPTTYRCYP3A4TSHRMEN1
SCHEMBL10699044 0.97 MAPT (0.44) MAPTTYRCYP3A4TSHRMEN1
SCHEMBL11375368 0.97 TLR8 (0.44) MAPTTYRCYP3A4TSHRMEN1
Bromide SCHEMBL27710135 0.95 TLR8 (0.43) MAPTTYRCYP3A4TSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1433211-A2 SUBSTITUTED PENTACENE SEMICONDUCTORS 3M Innovative Properties Company (US) 2004-06-30 EP claimed
WO-2003028125-A2 SUBSTITUTED PENTACENE SEMICONDUCTORS 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-04-03 WO claimed
CN-112837996-B Preparation method of thin-layer two-dimensional material 上海应用技术大学 2022-10-14 CN disclosed
CN-1922123-A Polyacene compound and organic semiconductor thin film ASAHI CHEMICAL CORP (JP) 2007-02-28 CN disclosed
CN-1592729-A Process for preparing pentacene derivatives 3M INNOVATIVE PROPERTIES CO (US) 2005-03-09 CN disclosed
CN-1582506-A Substituted pentacene semiconductors 3M INNOVATIVE PROPERTIES CO (US) 2005-02-16 CN disclosed
EP-1433211-A2 SUBSTITUTED PENTACENE SEMICONDUCTORS 3M Innovative Properties Company (US) 2004-06-30 EP disclosed
EP-1430008-A2 PROCESS FOR PREPARING PENTACENE DERIVATIVES 3M Innovative Properties Company (US) 2004-06-23 EP disclosed
WO-2003028125-A2 SUBSTITUTED PENTACENE SEMICONDUCTORS 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-04-03 WO disclosed
WO-2003027050-A2 PROCESS FOR PREPARING PENTACENE DERIVATIVES 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-04-03 WO disclosed