SCHEMBL5866515

SCHEMBL5866515

CCc1ccccc1C1(O)COC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.46
HDAC4 P56524 1/20 0.45
PDK2 Q15119 2/20 0.41
GABRA1 P14867 2/20 0.38
GABRB2 P47870 2/20 0.38
OPRL1 P41146 9/20 0.35
OPRM1 P35372 8/20 0.35
OPRD1 P41143 8/20 0.35
OPRK1 P41145 8/20 0.35
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
CTSB P07858 1/20 0.34
KMT2A Q03164 1/20 0.33

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
SCHEMBL5866535 0.86 OPRL1 (0.35) CYP2D6HDAC4PDK2OPRL1OPRM1
SCHEMBL27379046 0.76 CYP2D6 (0.49) CYP2D6HDAC4PDK2GABRA1GABRB2
SCHEMBL5866512 0.75 OPRM1 (0.46) HDAC4PDK2OPRL1OPRM1OPRD1
SCHEMBL23933927 0.71 HDAC4 (0.49) CYP2D6HDAC4PDK2GABRA1GABRB2
SCHEMBL21232438 0.71 ALOX15 (0.36) PDK2ALDH1A1
SCHEMBL25001304 0.70 GABRA1 (0.41) CYP2D6PDK2GABRA1GABRB2MAPT
SCHEMBL7320649 0.69 CYP2D6 (0.58) CYP2D6HDAC4PDK2GABRA1GABRB2
SCHEMBL22750609 0.68 SLC6A3 (0.41) CYP2D6ALDH1A1GAAMAPTKMT2A
SCHEMBL3241969 0.68 CYP2D6 (0.40) CYP2D6HDAC4PDK2GABRA1GABRB2
SCHEMBL21858428 0.67 OPRM1 (0.38) HDAC4PDK2OPRL1OPRM1OPRD1

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