SCHEMBL5458142

SCHEMBL5458142

OCC(O)COc1cc[c]c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
FGFR1 P11362 1/20 0.39
AR P10275 1/20 0.39
CYP1A2 P05177 3/20 0.38
KDM4E B2RXH2 2/20 0.38
AGTR1 P30556 1/20 0.38
LMNA P02545 1/20 0.38
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
P2RY12 Q9H244 1/20 0.38
MAPK14 Q16539 5/20 0.37
ALDH2 P05091 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
HIF1A Q16665 1/20 0.36
MEN1 O00255 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
PIK3CG P48736 1/20 0.36

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
SCHEMBL9934322 0.81 TSHR (0.50) TSHRMAPK1FGFR1ARCYP1A2
SCHEMBL5097237 0.81 TSHR (0.54) TSHRMAPK1FGFR1ARCYP1A2
SCHEMBL5106296 0.81 MAPK1 (0.50) TSHRMAPK1FGFR1ARCYP1A2
SCHEMBL5459138 0.80 MAPK1 (0.47) TSHRMAPK1FGFR1ARCYP1A2
SCHEMBL28463041 0.80 MGLL (0.33)
SCHEMBL28008558 0.78 TSHR (0.48) TSHRMAPK1FGFR1ARCYP1A2
SCHEMBL16741121 0.76 ALDH1A1 (0.44) PDE3BPDE3AP2RY12MAPK14ALDH2
SCHEMBL5655717 0.75 TSHR (0.50) TSHRMAPK1FGFR1ARCYP1A2
SCHEMBL921393 0.74 GPBAR1 (0.39) LMNA
SCHEMBL3671328 0.73 MAPK1 (0.83) TSHRMAPK1FGFR1CYP1A2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070249620-A1 Urea Derivative SANKYO COMPANY, LIMITED (JP) 2007-10-25 US disclosed
EP-1764360-A1 UREA DERIVATIVE Sankyo Company, Limited (JP) 2007-03-21 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-20070249620-A1 Urea Derivative UGP2, SLC14A1, DGAT1 TSHR 1728/4885MAPK1 1466/4885FGFR1 3081/4885

“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.