SCHEMBL6701609

SCHEMBL6701609

C1=CC2(Oc3ccccc31)Oc1cc(N(Cc3ccccc3)Cc3ccccc3)ccc1C=C2c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.35
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
HIF1A Q16665 2/20 0.32
EPAS1 Q99814 2/20 0.32
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL4005975 1.00 CYP2C19 (0.35) CYP2C19HTTNPSR1CRHBPCRHR2
SCHEMBL11268720 0.92 CYP2C19 (0.34) CYP2C19CRHBPCRHR2HIF1AEPAS1
SCHEMBL3877465 0.89 CA12 (0.33) HTTHIF1AEPAS1
SCHEMBL11280803 0.85 CA12 (0.35) HTTHIF1AEPAS1
SCHEMBL9333313 0.84 HTR2C (0.32)
SCHEMBL6262175 0.83 CYP2C19 (0.36) CYP2C19HTTNPSR1CRHBPCRHR2
SCHEMBL8765040 0.83 CYP2C19 (0.36) CYP2C19HTTNPSR1CRHBPCRHR2
SCHEMBL11264128 0.81 CA12 (0.33) HTT
SCHEMBL11259985 0.81 CA12 (0.33) HTT
SCHEMBL8685158 0.81 HTR2C (0.41) HTTNPSR1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004112006-A2 TOKEN BEARING MAGNETIC IMAGE INFORMATION IN REGISTRATION WITH VISIBLE IMAGE INFORMATION APPLETON PAPERS INC. (US) 2004-12-23 WO disclosed
WO-2004112005-A2 TOKEN BEARING MAGNETIC IMAGE INFORMATION IN REGISTRATION WITH VISIBLE IMAGE INFORMATION APPLETON PAPERS INC. (US) 2004-12-23 WO disclosed