SCHEMBL4460928

SCHEMBL4460928

O=C(O)c1ccc(-c2cc3ccccc3o2)c(C(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.53
TSHR P16473 2/20 0.53
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA3 P07451 1/20 0.53
CA4 P22748 1/20 0.53
CA6 P23280 1/20 0.53
CA5A P35218 1/20 0.53
CA7 P43166 1/20 0.53
CA9 Q16790 1/20 0.53
GPR35 Q9HC97 1/20 0.53
CA14 Q9ULX7 1/20 0.53
CA5B Q9Y2D0 1/20 0.53
CSNK2A1 P68400 1/20 0.48
MAOA P21397 2/20 0.47
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
TP53 P04637 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KDM5A P29375 1/20 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
Potassium SCHEMBL31668788 0.99 MAOB (0.51) MAOBTSHRCA12CA1CA3
SCHEMBL2209825 0.84 TSHR (0.58) MAOBTSHRCA12CA1CA3
SCHEMBL30285970 0.81 CSNK2A1 (0.52) MAOBTSHRCA12CA1CA3
SCHEMBL31052258 0.81 MAOB (0.45) MAOBTSHRCA12CA1CA3
SCHEMBL28621354 0.81 MIF (0.45) MAOBTSHRCA12CA1CA3
SCHEMBL3338142 0.81 MAOB (0.58) MAOBTSHRCA12CA1CA3
SCHEMBL980203 0.78 TNKS (0.66) MAOBTSHRCA12CA1CA3
SCHEMBL5787754 0.78 MIF (0.53) MAOBTSHRCA12CA1CA4
SCHEMBL27468894 0.78 NPC1 (0.58) MAOBTSHRCA12CA1CA3
SCHEMBL27690303 0.76 MAOB (0.49) MAOBTSHRCA12CA1CA3

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
EP-1490691-B1 LUMINESCENT, SPHEROID, NON-AUTOFLUORESCENT SILICA GEL PARTICLES HAVING VARIABLE EMISSION INTENSITIES AND FREQUENCIES MAGNAMEDICS GMBH (DE) 2009-01-21 EP disclosed
US-20050147974-A1 Luminescent, spherical, non-autofluorescent silica gel particles having variable emission intensities and frequencies MAGNAMEDICS GMBH (DE) 2005-07-07 US disclosed
EP-1490691-A2 LUMINESCENT, SPHEROID, NON-AUTOFLUORESCENT SILICA GEL PARTICLES HAVING VARIABLE EMISSION INTENSITIES AND FREQUENCIES Müller-Schulte, Detlef P. (DE) 2004-12-29 EP disclosed
WO-2003083481-A2 LUMINESCENT, SPHEROID, NON-AUTOFLUORESCENT SILICA GEL PARTICLES HAVING VARIABLE EMISSION INTENSITIES AND FREQUENCIES MUELLER-SHULTE DETLEF P (DE) 2003-10-09 WO disclosed