SCHEMBL8556505

SCHEMBL8556505

C=CCOc1c2cccc1Cc1cccc(c1O)Cc1cccc(c1OC)Cc1cccc(c1O)C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTA1 P08263 5/20 0.41
GSTP1 P09211 5/20 0.41
PTPRC P08575 4/20 0.41
PTPN2 P17706 4/20 0.41
PTPN1 P18031 4/20 0.41
PTPRB P23467 4/20 0.41
PTPN11 Q06124 4/20 0.41
CD69 Q07108 1/20 0.41
MGAM O43451 4/20 0.40
GAA P10253 4/20 0.40
SI P14410 4/20 0.40
MGAM2 Q2M2H8 4/20 0.40
ADRA2A P08913 1/20 0.39
ADRA2B P18089 1/20 0.39
ADRA2C P18825 1/20 0.39
CXCR5 P32302 1/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
HSD17B10 Q99714 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL1473328 0.84 CD69 (0.48) PTPRCCD69ADRA2AADRA2BADRA2C
SCHEMBL1144971 0.82 GSTA1 (0.41) GSTA1GSTP1PTPRCPTPN2PTPN1
SCHEMBL759347 0.82 GSTA1 (0.41) GSTA1GSTP1PTPRCPTPN2PTPN1
SCHEMBL1724552 0.78 CD69 (0.49) GSTA1GSTP1PTPRCPTPN2PTPN1
SCHEMBL4586959 0.75 GSTA1 (0.48) GSTA1GSTP1PTPRCPTPN2PTPN1
SCHEMBL2108268 0.73 CD69 (0.44) PTPRCPTPN2PTPN1PTPRBPTPN11
SCHEMBL15541243 0.73 KDM4E (0.43) CD69KDM4ESMN1; SMN2PTGS2
SCHEMBL1724955 0.72 CD69 (0.53) GSTA1GSTP1PTPRCPTPN2PTPN1
SCHEMBL12856781 0.71 GSTA1 (0.41) GSTA1GSTP1PTPRCPTPN2PTPN1
SCHEMBL12856732 0.71 GSTA1 (0.67) GSTA1GSTP1PTPRCPTPN2PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0572599-B1 ION-SENSITIVE DYES KODAK LTD (GB) 1998-06-17 EP disclosed
US-5641684-A Ion-sensitive dyes JOHNSON & JOHNSON CLINICAL DIAGNOSTICS, INC. (US) 1997-06-24 US disclosed
WO-1993012428-A1 ION-SENSITIVE DYES KODAK LIMITED (GB) 1993-06-24 WO disclosed