SCHEMBL4489932

SCHEMBL4489932

CCOC(=O)[C@H]1CCC[C@H]1NCCC1CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 2/20 0.40
TAS1R1 Q7RTX1 2/20 0.40
JAK1 P23458 1/20 0.39
CTSB P07858 1/20 0.37
ALDH1A1 P00352 4/20 0.35
HPGD P15428 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
METAP2 P50579 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CHRM1 P11229 2/20 0.32
PPM1B O75688 1/20 0.32
PTPN1 P18031 1/20 0.32
PPP1CC P36873 1/20 0.32
TP53 P04637 1/20 0.32
GAA P10253 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL4485203 1.00 TAS1R3 (0.40) TAS1R3TAS1R1JAK1CTSBALDH1A1
SCHEMBL4485198 1.00 TAS1R3 (0.40) TAS1R3TAS1R1JAK1CTSBALDH1A1
SCHEMBL4489935 1.00 TAS1R3 (0.40) TAS1R3TAS1R1JAK1CTSBALDH1A1
SCHEMBL4485200 1.00 TAS1R3 (0.40) TAS1R3TAS1R1JAK1CTSBALDH1A1
SCHEMBL4484877 0.85 TAS1R3 (0.41) TAS1R3TAS1R1JAK1CTSBALDH1A1
SCHEMBL4499466 0.84 SSTR3 (0.41) TAS1R3TAS1R1JAK1CTSBALDH1A1
SCHEMBL4485499 0.84 SSTR3 (0.41) TAS1R3TAS1R1JAK1CTSBALDH1A1
SCHEMBL4485497 0.84 SSTR3 (0.41) TAS1R3TAS1R1JAK1CTSBALDH1A1
SCHEMBL4487194 0.84 SSTR3 (0.41) TAS1R3TAS1R1JAK1CTSBALDH1A1
SCHEMBL4485502 0.84 SSTR3 (0.41) TAS1R3TAS1R1JAK1CTSBALDH1A1

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-7582626-B2 5,6-dihydro-1H-pyridin-2-one compounds ANADYS PHARMACEUTICALS, INC. (US) 2009-09-01 US disclosed
US-20090111798-A1 5,6-DIHYDRO-1H-PYRIDIN-2-ONE COMPOUNDS ANADYS PHARMACEUTICALS, INC. 2009-04-30 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-20090111798-A1 5,6-DIHYDRO-1H-PYRIDIN-2-ONE COMPOUNDS HAVCR2, PYGL, HCCS TAS1R3 4286/4885TAS1R1 4108/4885JAK1 1450/4885

“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.