SCHEMBL989475

SCHEMBL989475

C=CN(CCCCCC)CCCCCCCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.64
SIGMAR1 Q99720 7/20 0.57
OPRM1 P35372 2/20 0.47
DRD3 P35462 2/20 0.47
DRD2 P14416 1/20 0.47
OPRD1 P41143 1/20 0.47
OPRK1 P41145 1/20 0.47
BCHE P06276 1/20 0.46
CHRM2 P08172 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA2A P08913 1/20 0.46
CHRM1 P11229 1/20 0.46
DRD1 P21728 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
ADRA1A P35348 1/20 0.46
SLC6A3 Q01959 1/20 0.46
THRA P10827 3/20 0.46
THRB P10828 3/20 0.46

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
SCHEMBL988252 0.94 KCNH2 (0.55) KCNH2SIGMAR1OPRM1DRD3DRD2
SCHEMBL6658937 0.94 KCNH2 (0.55) KCNH2SIGMAR1OPRM1DRD3DRD2
Hydrochloric Acid SCHEMBL1551907 0.92 KCNH2 (0.54) KCNH2SIGMAR1OPRM1DRD3DRD2
SCHEMBL27527563 0.87 KCNH2 (0.50) KCNH2SIGMAR1OPRM1DRD3DRD2
SCHEMBL9602480 0.87 KCNH2 (0.50) KCNH2SIGMAR1OPRM1DRD3DRD2
Hydrochloric Acid SCHEMBL27850433 0.85 KCNH2 (0.49) KCNH2SIGMAR1OPRM1DRD3DRD2
Hydrochloric Acid SCHEMBL27850434 0.85 KCNH2 (0.49) KCNH2SIGMAR1OPRM1DRD3DRD2
SCHEMBL9500849 0.85 KCNH2 (0.47) KCNH2SIGMAR1OPRM1DRD3DRD2
SCHEMBL28335425 0.84 KCNH2 (0.59) KCNH2SIGMAR1CHRM2ADRA2ACHRM1
SCHEMBL855604 0.81 KCNH2 (0.44) KCNH2SIGMAR1BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1866166-B1 INK SET FOR INK JET RECORDING, INK FOR INK JET RECORDING, AND INK JET IMAGE RECORDING METHOD FUJIFILM CORP (JP) 2012-10-24 EP disclosed
US-7866807-B2 Ink set for ink jet recording, ink for ink jet recording, and ink jet image recording method FUJIFILM CORPORATION (JP) 2011-01-11 US disclosed
US-7857407-B2 Image forming apparatus FUJIFILM CORPORATION (JP) 2010-12-28 US disclosed
US-7753462-B2 Image forming apparatus FUJIFILM CORPORATION (JP) 2010-07-13 US disclosed
US-7712887-B2 Image forming apparatus FUJIFILM CORPORATION (JP) 2010-05-11 US disclosed
US-7651213-B2 Image forming apparatus and image forming method FUJIFILM CORPORATION (JP) 2010-01-26 US disclosed
US-20090081367-A1 Ink set for ink jet recording, ink for ink jet recording, and ink jet image recording method FUJIFILM CORPORATION (JP) 2009-03-26 US disclosed
EP-1866166-A1 INK SET FOR INK JET RECORDING, INK FOR INK JET RECORDING, AND INK JET IMAGE RECORDING METHOD FUJIFILM CORPORATION (JP) 2007-12-19 EP disclosed
US-20070046715-A1 Image forming apparatus FUJI PHOTO FILM CO., LTD. 2007-03-01 US disclosed
US-20070046719-A1 Image forming apparatus FUJI PHOTO FILM CO., LTD. 2007-03-01 US disclosed
US-20070024686-A1 Image forming apparatus FUJI PHOTO FILM CO., LTD. 2007-02-01 US disclosed
US-20070024684-A1 Image forming apparatus and image forming method FUJI PHOTO FILM CO., LTD. 2007-02-01 US disclosed
WO-2006104281-A1 INK SET FOR INK JET RECORDING, INK FOR INK JET RECORDING, AND INK JET IMAGE RECORDING METHOD FUJIFILM CORPORATION (JP) 2006-10-05 WO disclosed