SCHEMBL499877

SCHEMBL499877

CC(C)(CN1CCCC1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 4/20 0.40
HRH1 P35367 3/20 0.40
HTR2C P28335 9/20 0.38
DRD2 P14416 4/20 0.38
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CYP1A2 P05177 1/20 0.38
MAPK1 P28482 1/20 0.38
ATM Q13315 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
GAA P10253 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
HTR2B P41595 1/20 0.35

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
SCHEMBL3696273 0.98 SMN1; SMN2 (0.41) HTR2AHRH1HTR2CDRD2ALDH1A1
Hydrochloric Acid SCHEMBL48286 0.93 HRH1 (0.39) HTR2AHRH1HTR2CDRD2ALDH1A1
SCHEMBL3690635 0.83 HTR2A (0.44) HTR2AHRH1HTR2CDRD2ALDH1A1
SCHEMBL13993921 0.82 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2CYP1A2MAPK1ATM
SCHEMBL7361325 0.81 HSD17B10 (0.48) ALDH1A1SMN1; SMN2GAA
SCHEMBL22557833 0.81 SIGMAR1 (0.45) HTR2AHRH1HTR2CDRD2ALDH1A1
SCHEMBL3683753 0.81 ARG1 (0.39) HTR2AHRH1HTR2CDRD2ALDH1A1
SCHEMBL13993907 0.80 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2CYP1A2MAPK1NPSR1
SCHEMBL5232657 0.80 L3MBTL1 (0.42) ALDH1A1SMN1; SMN2CYP1A2MAPK1ATM
SCHEMBL13993911 0.80 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2CYP1A2MAPK1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116925077-A Pyrido ring compound, and preparation method, intermediate, composition and application thereof 一又生物(上海)有限公司 2023-10-24 CN disclosed
US-20230322689-A1 IONIZABLE LIPID COMPOUNDS AND LIPID NANOPARTICLE COMPOSITIONS SunVax mRNA Therapeutics Inc. (US) 2023-10-12 US disclosed
CN-114149428-B Pyrido ring compound, and preparation method, intermediate, composition and application thereof 中国药科大学 2023-06-13 CN disclosed
CN-114149428-A Pyridine-fused ring compound and preparation method, intermediate, composition and application thereof 中国药科大学 2022-03-08 CN disclosed
US-8105760-B2 Patterning process and pattern surface coating composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-01-31 US disclosed
US-20090053657-A1 PATTERNING PROCESS AND PATTERN SURFACE COATING COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2009-02-26 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-20230322689-A1 IONIZABLE LIPID COMPOUNDS AND LIPID NANOPARTICLE COMPOSITIONS PHOSPHO1, SGMS1, PLIN3 HTR2A 4866/4885HRH1 4024/4885HTR2C 4859/4885

“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.