SCHEMBL5282382

SCHEMBL5282382

Cc1ccc(OCCOc2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.62
KDM4E B2RXH2 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.52
HRH3 Q9Y5N1 2/20 0.51
DRD2 P14416 3/20 0.50
DRD4 P21917 3/20 0.50
DRD3 P35462 3/20 0.50
APP P05067 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
NPC1 O15118 3/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
RAB9A P51151 2/20 0.47
MITF O75030 1/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
CYP3A4 P08684 1/20 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
SCHEMBL20234326 0.85 HRH3 (0.61) KDM4ESMN1; SMN2HRH3APPNPC1
SCHEMBL22248702 0.85 HRH3 (0.62) KDM4ESMN1; SMN2HRH3APPNPC1
SCHEMBL313373 0.84 DRD2 (0.64) KDM4EDRD2DRD4DRD3L3MBTL1
SCHEMBL5285127 0.83 ALDH1A1 (0.57) KDM4ESMN1; SMN2HRH3APPL3MBTL1
SCHEMBL1535647 0.83 KDM4E (0.54) KDM4ESMN1; SMN2HRH3APPNPC1
SCHEMBL3807523 0.83 RAB9A (0.59) KDM4ESMN1; SMN2HRH3NPC1MEN1
SCHEMBL5287502 0.83 KDM4E (0.55) TSHRKDM4ESMN1; SMN2HRH3L3MBTL1
SCHEMBL5279217 0.83 TDP1 (0.50) TSHRKDM4ESMN1; SMN2HRH3DRD2
SCHEMBL22248703 0.83 HRH3 (0.65) KDM4ESMN1; SMN2HRH3APPNPC1
SCHEMBL24476179 0.82 TSHR (0.56) TSHRKDM4ESMN1; SMN2HRH3DRD2

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