SCHEMBL4949353

SCHEMBL4949353

COC(=O)c1ccc(-c2cccc(F)c2)o1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.70
NR4A2 P43354 1/20 0.70
NR4A3 Q92570 1/20 0.70
SLC9A1 P19634 1/20 0.60
PDE4B Q07343 5/20 0.56
MGAM O43451 3/20 0.54
GAA P10253 3/20 0.54
SI P14410 3/20 0.54
MGAM2 Q2M2H8 3/20 0.54
CYP1A2 P05177 1/20 0.52
CYP2C19 P33261 1/20 0.52
ALDH1A1 P00352 2/20 0.50
HPGD P15428 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALOX15 P16050 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CREBBP Q92793 1/20 0.50
HSD17B10 Q99714 1/20 0.50
NQO2 P16083 1/20 0.50

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
SCHEMBL4945642 0.86 SLC9A1 (0.57) NR4A1NR4A2NR4A3SLC9A1PDE4B
SCHEMBL13078324 0.84 NR4A1 (0.74) NR4A1NR4A2NR4A3SLC9A1PDE4B
SCHEMBL4943045 0.83 SLC9A1 (0.62) NR4A1NR4A2NR4A3SLC9A1CYP1A2
SCHEMBL1317340 0.83 HSD17B1 (0.55) NR4A1NR4A2NR4A3SLC9A1PDE4B
SCHEMBL3050183 0.83 NR4A1 (1.00) NR4A1NR4A2NR4A3SLC9A1PDE4B
SCHEMBL4939182 0.82 SLC9A1 (0.65) SLC9A1CYP1A2CYP2C19ALDH1A1HPGD
SCHEMBL4945600 0.82 ALDH1A1 (0.67) SLC9A1PDE4BMGAMGAASI
SCHEMBL1143419 0.82 ALDH1A1 (0.53) NR4A1NR4A2NR4A3SLC9A1GAA
SCHEMBL6671019 0.81 NR4A1 (0.74) NR4A1NR4A2NR4A3SLC9A1PDE4B
SCHEMBL29353751 0.81 NR4A1 (0.74) NR4A1NR4A2NR4A3SLC9A1PDE4B

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 NR4A1 4396/4885NR4A2 4318/4885NR4A3 4355/4885

“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.