SCHEMBL19002800

SCHEMBL19002800

CCC(=O)N1CCOC(c2cccc(F)c2)C1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 8/20 0.48
EPHX2 P34913 1/20 0.45
PDE2A O00408 1/20 0.43
SCD5 Q86SK9 1/20 0.42
USP30 Q70CQ3 1/20 0.41
NAMPT P43490 1/20 0.41
CHRM2 P08172 1/20 0.40
HTR1A P08908 1/20 0.40
HTR2B P41595 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HPGDS O60760 1/20 0.40
GRIN2B Q13224 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
SCHEMBL19002798 0.86 DRD3 (0.65) DRD3HTR1A
SCHEMBL19049383 0.86 DRD3 (0.45) DRD3PDE2ASCD5USP30NAMPT
SCHEMBL2294363 0.86 LMNA (0.52) DRD3PDE2AGRIN2B
SCHEMBL2295935 0.86 LMNA (0.52) DRD3PDE2AGRIN2B
SCHEMBL19002795 0.85 DRD3 (0.48) DRD3EPHX2PDE2AUSP30NPC1
SCHEMBL4598876 0.85 SCD5 (0.44) DRD3PDE2ASCD5USP30NAMPT
SCHEMBL3369775 0.85 SCD5 (0.44) DRD3PDE2ASCD5USP30NAMPT
SCHEMBL19002793 0.85 MEN1 (0.46) DRD3EPHX2PDE2ANAMPTMEN1
SCHEMBL3375799 0.85 SCD5 (0.44) DRD3PDE2ASCD5USP30NAMPT
SCHEMBL14035660 0.84 USP30 (0.51) DRD3EPHX2USP30RAB9AMEN1

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-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE SHY Therapeutics LLC 2017-06-22 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-20170174699-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMATORY DISEASE MAPK6, MAP3K6, MAPK4 DRD3 4860/4885EPHX2 2625/4885PDE2A 2134/4885

“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.