SCHEMBL3694182

SCHEMBL3694182

CN1CCCC(OC(N)=O)C1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.61
HTT P42858 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
CYP2D6 P10635 2/20 0.52
POLB P06746 1/20 0.52
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ATM Q13315 1/20 0.49
ALDH1A1 P00352 1/20 0.47
CYP3A4 P08684 1/20 0.47

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
SCHEMBL28339538 1.00 SMN1; SMN2 (0.61) SMN1; SMN2HTTL3MBTL1CYP2D6POLB
SCHEMBL27038904 0.89 CHRM4 (0.51) SMN1; SMN2HTTL3MBTL1CYP2D6POLB
SCHEMBL4201270 0.89 CHRM4 (0.51) SMN1; SMN2HTTL3MBTL1CYP2D6POLB
SCHEMBL23931262 0.89 CHRM4 (0.51) SMN1; SMN2HTTL3MBTL1CYP2D6POLB
SCHEMBL6206557 0.83 SMN1; SMN2 (0.63) SMN1; SMN2HTTL3MBTL1CYP2D6POLB
SCHEMBL689750 0.83 SMN1; SMN2 (0.63) SMN1; SMN2HTTL3MBTL1CYP2D6POLB
SCHEMBL13003548 0.83 SMN1; SMN2 (0.63) SMN1; SMN2HTTL3MBTL1CYP2D6POLB
Hydrochloric Acid SCHEMBL32671816 0.80 SMN1; SMN2 (0.64) SMN1; SMN2HTTL3MBTL1CYP2D6POLB
SCHEMBL21873695 0.80
SCHEMBL28999414 0.79 ATM (0.43) SMN1; SMN2ATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110637015-A Farnesoin X receptor agonists and uses thereof 梅塔科林公司 2019-12-31 CN claimed
WO-2024017358-A1 MACROCYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF 贝达药业股份有限公司 2024-01-25 WO disclosed
US-20100331546-A1 METHOD FOR OPTICAL RESOLUTION OF ALKYL PIPERIDIN-3-YL CARBAMATE AND INTERMEDIATE THEREFOR SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-12-30 US disclosed
EP-2248803-A1 METHOD FOR OPTICAL RESOLUTION OF ALKYLPIPERIDIN-3-YL CARBAMATE AND INTERMEDIATE THEREFOR Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP 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-20100331546-A1 METHOD FOR OPTICAL RESOLUTION OF ALKYL PIPERIDIN-3-YL CARBAMATE AND INTERMEDIATE THEREFOR FAR1, NOTUM, CYP51A1 SMN1; SMN2 4735/4885HTT 987/4885L3MBTL1 2902/4885

“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.