SCHEMBL10123095

SCHEMBL10123095

Cc1ccc(N(CC(=O)O)CC(=O)O)c(OCCOc2cc(CNC(=O)c3c4oc5cc(O)ccc5nc-4ccc3=O)ccc2N(CC(=O)O)CC(=O)O)c1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.34
MAPT P10636 3/20 0.34
TP53 P04637 2/20 0.34
NAMPT P43490 2/20 0.33
LMNA P02545 1/20 0.33
MMP10 P09238 1/20 0.32
MMP8 P22894 1/20 0.32
MMP13 P45452 1/20 0.32
POLB P06746 4/20 0.32
KMT2A Q03164 2/20 0.32
THRB P10828 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 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
SCHEMBL15887243 0.97 TDP1 (0.33) MAOBMAPTTP53NAMPTLMNA
SCHEMBL10123096 0.94 MAOB (0.35) MAOBMAPTTP53NAMPTLMNA
SCHEMBL10123102 0.74 SCP2 (0.38) MAPTTP53NAMPTLMNAPOLB
SCHEMBL15887263 0.72 SCP2 (0.36) MAPTTP53NAMPTLMNAPOLB
SCHEMBL10264705 0.71 APP (0.44) MAOBMAPTTP53LMNANPC1
SCHEMBL10646569 0.69 TDP1 (0.55)
SCHEMBL10123099 0.68 MAPT (0.36) MAPTTP53NAMPTLMNAPOLB
SCHEMBL16003057 0.68 TDP1 (0.62)
SCHEMBL10205581 0.66 APP (0.55) MAPTLMNAPOLBKMT2ATHRB
SCHEMBL31517726 0.64 TDP1 (0.38) MAOBLMNAKMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9846168-B2 Fluorescent metal ion indicators with large stokes shifts Life Technologies Corporation (US) 2017-12-19 US disclosed
US-20160305964-A1 Fluorescent Metal Ion Indicators with Large Stokes Shifts MOLECULAR PROBES, INC. 2016-10-20 US disclosed
US-20160305964-A1 Fluorescent Metal Ion Indicators with Large Stokes Shifts MOLECULAR PROBES, INC. 2016-10-20 US disclosed
US-9372181-B2 Fluorescent metal ion indicators with large stokes shifts Life Technologies Corporation (US) 2016-06-21 US disclosed
US-9372181-B2 Fluorescent metal ion indicators with large stokes shifts Life Technologies Corporation (US) 2016-06-21 US disclosed
US-20140363824-A1 Fluorescent Metal Ion Indicators with Large Stokes Shifts MOLECULAR PROBES, INC. 2014-12-11 US disclosed
US-20140363824-A1 Fluorescent Metal Ion Indicators with Large Stokes Shifts MOLECULAR PROBES, INC. 2014-12-11 US disclosed
US-8785208-B2 Fluorescent metal ion indicators with large stokes shifts Life Technologies Corporation (US) 2014-07-22 US disclosed
US-8785208-B2 Fluorescent metal ion indicators with large stokes shifts Life Technologies Corporation (US) 2014-07-22 US disclosed
US-20120009683-A1 Fluorescent Metal Ion Indicators with Large Stokes Shifts Life Technologies Corporation (US) 2012-01-12 US disclosed
US-20100196922-A1 FLUORESCENT METAL ION INDICATORS WITH LARGE STOKES SHIFTS Life Technologies Corporation (US) 2010-08-05 US disclosed
US-20090029389-A1 FLUORESCENT METAL ION INDICATORS WITH LARGE STOKES SHIFTS INVITROGEN CORPORATION (US) 2009-01-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120009683-A1 Fluorescent Metal Ion Indicators with Large Stokes Shifts SARAF, STIM1, ORAI1 MAOB 4603/4885MAPT 1199/4885TP53 1714/4885
US-20100196922-A1 FLUORESCENT METAL ION INDICATORS WITH LARGE STOKES SHIFTS SARAF, STIM1, ORAI1 MAOB 4603/4885MAPT 1199/4885TP53 1714/4885
US-20160305964-A1 Fluorescent Metal Ion Indicators with Large Stokes Shifts SARAF, STIM1, ORAI1 MAOB 4603/4885MAPT 1199/4885TP53 1714/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.