SCHEMBL5067918

SCHEMBL5067918

COc1cccc(C(O)CNC(=O)O)c1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
TSHR P16473 1/20 0.45
CYP2C19 P33261 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
ADRA1A P35348 1/20 0.45
ADRB1 P08588 2/20 0.44
ADRB3 P13945 2/20 0.44
ADRA2A P08913 1/20 0.44
ADRA2B P18089 1/20 0.44
ADRA2C P18825 1/20 0.44
POLB P06746 1/20 0.43
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MTNR1A P48039 2/20 0.43
ADORA2A P29274 1/20 0.39
ADORA2B P29275 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39

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
SCHEMBL5061358 0.86 POLB (0.43) LMNAADRB1ADRB3ADRA2AADRA2B
SCHEMBL13997819 0.83 DRD2 (0.42) LMNACYP1A2TSHRCYP2C19ADORA3
SCHEMBL14690869 0.81 POLB (0.50) LMNAPOLBHTTNPSR1L3MBTL1
SCHEMBL4595555 0.77 POLB (0.39) POLBHTTNPSR1L3MBTL1CA12
SCHEMBL8594336 0.75 MTNR1A (0.61) LMNACYP1A2TSHRCYP2C19ADORA3
SCHEMBL20879262 0.75 TAS1R3 (0.40) ADRB1ADRB3ADRA2AADRA2BADRA2C
SCHEMBL14692188 0.75 ADRA2A (0.40) LMNACYP1A2TSHRADRA1AADRB1
SCHEMBL1643715 0.74 POLB (0.42) LMNATSHRPOLBHTTNPSR1
SCHEMBL1643713 0.74 POLB (0.42) LMNATSHRPOLBHTTNPSR1
SCHEMBL29364351 0.74 POLB (0.42) LMNATSHRPOLBHTTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080318947-A1 Inhibitors of Akt Activity HEERDING DIRK A 2008-12-25 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 (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-20080318947-A1 Inhibitors of Akt Activity PI4KB, PIK3CA, AKT2 LMNA 3066/4885CYP1A2 3985/4885TSHR 3185/4885

“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.