SCHEMBL4180872

SCHEMBL4180872

COc1ccc(OC)c(-c2cc3[nH]c(C(=O)O)cc3o2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.57
ALDH1A1 P00352 5/20 0.57
MAPT P10636 3/20 0.57
SLC9A1 P19634 1/20 0.46
KDM4E B2RXH2 5/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
HTT P42858 2/20 0.44
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
THRB P10828 1/20 0.44
CFTR P13569 1/20 0.44
ALOX12 P18054 1/20 0.44
MAPK1 P28482 1/20 0.44
RECQL P46063 1/20 0.44
BLM P54132 1/20 0.44
KMT2A Q03164 1/20 0.44
GOPC Q9HD26 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL4189884 0.85 ALDH1A1 (0.56) HPGDALDH1A1MAPTSLC9A1KDM4E
SCHEMBL4191153 0.82 NR4A2 (0.49) HPGDALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL9885771 0.74 ALDH1A1 (0.48) HPGDALDH1A1MAPTSLC9A1KDM4E
SCHEMBL21686585 0.72 HPGD (0.52) HPGDALDH1A1MAPTKDM4EHTT
Hydrochloric Acid SCHEMBL6344995 0.71 HPGD (0.51) HPGDALDH1A1MAPTKDM4EHTT
SCHEMBL27350271 0.70 DAO (0.50) HPGDALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL4397765 0.70 ALDH1A1 (0.48) HPGDALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL13949499 0.70 PIN1 (0.49) HPGDALDH1A1MAPTKDM4EUSP2
SCHEMBL27873986 0.69 ALDH1A1 (0.71) HPGDALDH1A1MAPTSLC9A1KDM4E
SCHEMBL335655 0.68 FLT3 (0.68) HPGDMAPTKDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2022794-B1 FLUORESCENT COMPOUND AND LABELING AGENT COMPRISING THE SAME UNIV KEIO (JP) 2017-08-23 EP disclosed
EP-2022794-B1 FLUORESCENT COMPOUND AND LABELING AGENT COMPRISING THE SAME UNIV KEIO (JP) 2017-08-23 EP disclosed
US-8193350-B2 Fluorescent compound and labeling agent comprising the same KEIO UNIVERSITY (JP) 2012-06-05 US disclosed
US-8193350-B2 Fluorescent compound and labeling agent comprising the same KEIO UNIVERSITY (JP) 2012-06-05 US disclosed
US-8193350-B2 Fluorescent compound and labeling agent comprising the same KEIO UNIVERSITY (JP) 2012-06-05 US disclosed
US-20090176313-A1 Fluorescent Compound and Labeling Agent Comprising the Same KEIO UNIVERSITY (JP) 2009-07-09 US disclosed
US-20090176313-A1 Fluorescent Compound and Labeling Agent Comprising the Same KEIO UNIVERSITY (JP) 2009-07-09 US disclosed
US-20090176313-A1 Fluorescent Compound and Labeling Agent Comprising the Same KEIO UNIVERSITY (JP) 2009-07-09 US disclosed
EP-2022794-A1 FLUORESCENT COMPOUND AND LABELING AGENT COMPRISING THE SAME Keio University (JP) 2009-02-11 EP disclosed
EP-2022794-A1 FLUORESCENT COMPOUND AND LABELING AGENT COMPRISING THE SAME Keio University (JP) 2009-02-11 EP 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 (1 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-20090176313-A1 Fluorescent Compound and Labeling Agent Comprising the Same IK, SLC46A1, RB1 HPGD 4229/4885ALDH1A1 2694/4885MAPT 4094/4885

“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.