SCHEMBL5288604

SCHEMBL5288604

Cc1cccc(OCCOc2ccc(C(C)(C)C)cc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.55
DRD4 P21917 2/20 0.55
DRD3 P35462 1/20 0.55
TDP1 Q9NUW8 4/20 0.55
L3MBTL1 Q9Y468 3/20 0.55
MAPK1 P28482 1/20 0.48
MAPT P10636 3/20 0.47
ALDH1A1 P00352 2/20 0.47
PLA2G1B P04054 1/20 0.47
ATG4B Q9Y4P1 1/20 0.47
POLB P06746 2/20 0.47
KDM4E B2RXH2 2/20 0.47
USP2 O75604 1/20 0.46
HPGD P15428 1/20 0.46
CXCR5 P32302 1/20 0.46
RAB9A P51151 3/20 0.46
F2 P00734 1/20 0.46
KMT2A Q03164 1/20 0.46
TP53 P04637 2/20 0.45
NPC1 O15118 2/20 0.44

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
SCHEMBL10796021 0.86 TDP1 (0.55) DRD2DRD4DRD3TDP1L3MBTL1
SCHEMBL2809711 0.84 DRD2 (0.73) DRD2DRD4DRD3TDP1L3MBTL1
SCHEMBL29381067 0.84 DRD2 (0.62) DRD2DRD4DRD3TDP1L3MBTL1
SCHEMBL27465 0.84 DRD2 (0.62) DRD2DRD4DRD3TDP1L3MBTL1
SCHEMBL10705548 0.83 CHRNB2 (0.57) DRD2DRD4DRD3MAPTPOLB
SCHEMBL3807523 0.82 RAB9A (0.59) MAPTPOLBKDM4ERAB9AKMT2A
SCHEMBL2063136 0.82 DRD2 (0.72) DRD2DRD4DRD3TDP1L3MBTL1
SCHEMBL5686017 0.82 DRD2 (0.72) DRD2DRD4DRD3TDP1L3MBTL1
SCHEMBL5282382 0.82 TSHR (0.62) DRD2DRD4DRD3L3MBTL1MAPT
SCHEMBL18161429 0.82 NR4A2 (0.63) MAPTTP53

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
WO-2006138653-A9 THERMAL RECORDING MATERIALS AND METHODS OF MAKING AND USING THE SAME NASHUA CORP (US) 2007-03-01 WO disclosed
US-20060293181-A1 Thermal recording materials and methods of making and using the same NASHUA CORPORATION 2006-12-28 US disclosed
WO-2006138653-A1 THERMAL RECORDING MATERIALS AND METHODS OF MAKING AND USING THE SAME NASHUA CORPORATION (US) 2006-12-28 WO disclosed
US-RE36321-E INCLUDING DIARYL DIETHER COMPOUND KANSAKI PAPER MANUFACTURING CO., LTD. (JP) 1999-09-28 US disclosed
EP-0141170-B1 HEAT-SENSITIVE RECORDING MATERIAL KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1987-05-13 EP disclosed
US-4659643-A A PHENOXY COMPOUND KANZAKI PAPER MANUFACTURING CO. LTD. (JP) 1987-04-21 US disclosed
US-4531140-A Heat-sensitive recording material Kansaki Paper Manufacturing Co. Ltd. (JP) 1985-07-23 US disclosed
EP-0141170-A2 Heat-sensitive recording material KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1985-05-15 EP disclosed