SCHEMBL5866535

SCHEMBL5866535

CCCc1ccccc1C1(O)COC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 10/20 0.35
OPRM1 P35372 9/20 0.35
OPRD1 P41143 9/20 0.35
OPRK1 P41145 9/20 0.35
PDK2 Q15119 2/20 0.34
CYP2D6 P10635 3/20 0.33
HDAC4 P56524 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2C19 P33261 2/20 0.32
CYP2C9 P11712 1/20 0.32
HTT P42858 1/20 0.32
LIPG Q9Y5X9 1/20 0.32

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
SCHEMBL5866515 0.86 CYP2D6 (0.46) OPRL1OPRM1OPRD1OPRK1PDK2
SCHEMBL29262368 0.79 HDAC4 (0.43) OPRL1OPRM1OPRD1OPRK1HDAC4
SCHEMBL25871738 0.72 OPRL1 (0.34) OPRL1OPRM1OPRD1OPRK1PDK2
SCHEMBL5866512 0.72 OPRM1 (0.46) OPRL1OPRM1OPRD1OPRK1PDK2
SCHEMBL11832466 0.70 ADRA2B (0.33) ADRA2BADRA2C
SCHEMBL21232438 0.68 ALOX15 (0.36) PDK2CYP3A4
SCHEMBL25001304 0.68 GABRA1 (0.41) PDK2CYP2D6CYP1A2CYP3A4CYP2C19
SCHEMBL8765841 0.68 HDAC4 (0.41) HDAC4
SCHEMBL23653461 0.68 HDAC4 (0.49) HDAC4
Hydrogen Peroxide SCHEMBL29092952 0.68 LIPG (0.45) ADRA2BADRA2CLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7048368-B2 Ink-jet image forming method KONICA CORPORATION (JP) 2006-05-23 US disclosed
US-7014310-B2 Inkjet image forming method and inkjet image forming system KONICA CORPORATION (JP) 2006-03-21 US disclosed
US-20040036753-A1 Ink-jet image forming method KONICA CORPORATION (JP) 2004-02-26 US disclosed
US-20030202079-A1 Inkjet image forming method and inkjet image forming system KONICA CORPORATION (JP) 2003-10-30 US disclosed