SCHEMBL4944722

SCHEMBL4944722

CCOc1ccccc1-c1ccc(C(=O)OC)o1

nearest known ligand 0.77

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.77
HPGD P15428 4/20 0.77
MAPT P10636 2/20 0.77
KDM4E B2RXH2 2/20 0.69
NPC1 O15118 1/20 0.69
RAB9A P51151 1/20 0.69
SLC9A1 P19634 2/20 0.67
TDP1 Q9NUW8 2/20 0.55
HSD17B10 Q99714 1/20 0.55
L3MBTL1 Q9Y468 2/20 0.49
HTT P42858 2/20 0.48
KMT2A Q03164 1/20 0.48
S1PR4 O95977 1/20 0.47
S1PR5 Q9H228 1/20 0.47
GLA P06280 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
SCHEMBL4937754 0.85 ALDH1A1 (0.74) ALDH1A1HPGDMAPTKDM4ENPC1
SCHEMBL4946224 0.81 SLC9A1 (0.69) ALDH1A1HPGDMAPTKDM4ENPC1
SCHEMBL4941515 0.81 ALDH1A1 (0.66) ALDH1A1HPGDMAPTKDM4ENPC1
SCHEMBL4937608 0.81 SLC9A1 (0.62) ALDH1A1HPGDMAPTKDM4ENPC1
SCHEMBL4941523 0.80 SLC9A1 (1.00) ALDH1A1HPGDMAPTKDM4ENPC1
SCHEMBL4943006 0.80 SLC9A1 (0.67) ALDH1A1HPGDMAPTKDM4ENPC1
SCHEMBL4945650 0.80 SLC9A1 (0.64) ALDH1A1HPGDMAPTKDM4ENPC1
SCHEMBL4946365 0.77 ALDH1A1 (0.61) ALDH1A1HPGDMAPTKDM4ENPC1
SCHEMBL30175784 0.76 ALDH1A1 (0.63) ALDH1A1HPGDMAPTKDM4ENPC1
SCHEMBL27669256 0.76 ALDH1A1 (0.63) ALDH1A1HPGDMAPTKDM4ENPC1

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
US-7351843-B2 Furancarbonylguanidine derivatives, their preparation and pharmaceutical compositions containing them KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2008-04-01 US disclosed
US-20070299131-A1 Furancarbonylguanidine Derivatives, Their Preparation and Pharmaceutical Compositions Containing Them KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2007-12-27 US disclosed
EP-1697335-A1 FURANCARBONYLGUANIDINE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2006-09-06 EP disclosed
WO-2005063727-A1 FURANCARBONYLGUANIDINE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2005-07-14 WO 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-20070299131-A1 Furancarbonylguanidine Derivatives, Their Preparation and Pharmaceutical Compositions Containing Them SLC9A1, NHERF1, SLC5A1 ALDH1A1 297/4885HPGD 242/4885MAPT 4846/4885

“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.