SCHEMBL30889121

SCHEMBL30889121

NS(=O)(=O)C1CCCCNC1

nearest known ligand 0.88

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APLNR P35414 2/20 0.88
CYP2D6 P10635 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
ATM Q13315 1/20 0.41
NOS2 P35228 1/20 0.36
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
SLC6A1 P30531 2/20 0.33
TSHR P16473 2/20 0.33
LMNA P02545 2/20 0.33
SLC6A11 P48066 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLC6A13 Q9NSD5 1/20 0.33
CYP3A4 P08684 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRG2 P18507 1/20 0.32
NFKB1 P19838 1/20 0.32
GABRB3 P28472 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
SCHEMBL25040398 1.00 APLNR (0.88) APLNRCYP2D6KDM4EMAPTKMT2A
SCHEMBL18254435 0.93 APLNR (1.00) APLNRCYP2D6KDM4EMAPTKMT2A
SCHEMBL1546863 0.93 APLNR (1.00) APLNRCYP2D6KDM4EMAPTKMT2A
SCHEMBL18254434 0.93 APLNR (1.00) APLNRCYP2D6KDM4EMAPTKMT2A
Hydrochloric Acid SCHEMBL18246458 0.91 APLNR (0.96) APLNRCYP2D6KDM4EMAPTKMT2A
Hydrochloric Acid SCHEMBL18246857 0.91 APLNR (0.96) APLNRCYP2D6KDM4EMAPTKMT2A
Hydrochloric Acid SCHEMBL18246459 0.91 APLNR (0.96) APLNRCYP2D6KDM4EMAPTKMT2A
SCHEMBL22778484 0.84
SCHEMBL4717765 0.84
Acetic Acid SCHEMBL20187787 0.83 APLNR (0.79) APLNRCYP2D6KDM4EMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117881397-A Heterocyclic compounds and methods of use 安进公司 2024-04-12 CN claimed
US-20250034167-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2025-01-30 US disclosed
CN-117881397-A Heterocyclic compounds and methods of use 安进公司 2024-04-12 CN 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-20250034167-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE KRAS, NRAS, HRAS APLNR 4323/4885CYP2D6 798/4885KDM4E 3276/4885

“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.