SCHEMBL22048856

SCHEMBL22048856

Cn1ncc2c1CCC(CC=O)C2=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 7/20 0.45
HTR1A P08908 6/20 0.45
DRD2 P14416 6/20 0.45
PLK1 P53350 1/20 0.45
CSNK2A1 P68400 1/20 0.45
PLK3 Q9H4B4 1/20 0.45
ELANE P08246 2/20 0.35
HIF1A Q16665 1/20 0.33
HTR2C P28335 1/20 0.31
CYP3A4 P08684 2/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
HTR3E A5X5Y0 1/20 0.30
SLC22A2 O15244 1/20 0.30
SLC22A1 O15245 1/20 0.30
SLC22A3 O75751 1/20 0.30
HTR3B O95264 1/20 0.30
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30

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
SCHEMBL22048623 0.92 PLK1 (0.50) HTR2AHTR1ADRD2PLK1CSNK2A1
SCHEMBL9218236 0.71 PLK1 (0.47) HTR2AHTR1ADRD2PLK1CSNK2A1
Hydrochloric Acid SCHEMBL9534437 0.68 PLK1 (0.59) HTR2AHTR1ADRD2PLK1CSNK2A1
SCHEMBL17901964 0.67 PLK1 (0.58) HTR2AHTR1ADRD2PLK1CSNK2A1
SCHEMBL17901904 0.67 PLK1 (0.58) HTR2AHTR1ADRD2PLK1CSNK2A1
SCHEMBL9535703 0.66 PLK1 (0.61) HTR2AHTR1ADRD2PLK1CSNK2A1
SCHEMBL9220615 0.66 PLK1 (0.53) HTR2AHTR1ADRD2PLK1CSNK2A1
SCHEMBL22980483 0.66 PLK1 (0.79) HTR2AHTR1ADRD2PLK1CSNK2A1
SCHEMBL9431516 0.65 CYP19A1 (0.56) HTR2AHTR1ADRD2HTR2CCYP3A4
SCHEMBL9533236 0.65 PLK1 (0.41) HTR2AHTR1ADRD2PLK1CSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230008875-A1 SUBSTITUTED LACTAMS SHOWING SEROTONIN 5-HT RECEPTOR ACTIVITY Sumitomo Pharma Co., Ltd. (JP) 2023-01-12 US disclosed
EP-3828182-A1 FUSED RING LACTAM DERIVATIVES Sumitomo Dainippon Pharma Co., Ltd. (JP) 2021-06-02 EP disclosed
US-10745401-B2 Condensed lactam derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-08-18 US disclosed
US-20200255432-A1 CONDENSED LACTAM DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-08-13 US disclosed
US-20200172543-A1 CONDENSED LACTAM DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-06-04 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 (4 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-20200255432-A1 CONDENSED LACTAM DERIVATIVE PSEN1, GRIN1, HDAC1 HTR2A 947/4885HTR1A 362/4885DRD2 430/4885
US-10745401-B2 Condensed lactam derivative PSEN1, GRIN1, HDAC1 HTR2A 947/4885HTR1A 362/4885DRD2 430/4885
US-20230008875-A1 SUBSTITUTED LACTAMS SHOWING SEROTONIN 5-HT RECEPTOR ACTIVITY HTR1A, HTR5A, TPH1 HTR2A 10/4885HTR1A 1/4885DRD2 59/4885
US-20200172543-A1 CONDENSED LACTAM DERIVATIVE PSEN1, GRIN1, HDAC1 HTR2A 947/4885HTR1A 362/4885DRD2 430/4885

“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.