SCHEMBL22043589

SCHEMBL22043589

CC(C)C1(S)CNC(=O)C1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.43
TOP2A P11388 1/20 0.31
TOP2B Q02880 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
OPRM1 P35372 1/20 0.30
OPRL1 P41146 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
SCHEMBL14413824 0.73 SMN1; SMN2 (0.46) SMN1; SMN2TOP2ATOP2BALDH1A1MAPT
SCHEMBL22135875 0.70 SMN1; SMN2 (0.43) SMN1; SMN2TOP2ATOP2BALDH1A1MAPT
SCHEMBL11787452 0.68 SMN1; SMN2 (0.47) SMN1; SMN2TOP2ATOP2BALDH1A1MAPT
SCHEMBL24399158 0.67 SMN1; SMN2 (0.41) SMN1; SMN2
SCHEMBL7438734 0.67 SMN1; SMN2 (0.41) SMN1; SMN2
SCHEMBL11788478 0.67 SMN1; SMN2 (0.50) SMN1; SMN2
SCHEMBL16885243 0.67 SMN1; SMN2 (0.45) SMN1; SMN2
SCHEMBL3743719 0.64
SCHEMBL248285 0.64
SCHEMBL4289914 0.63 SMN1; SMN2 (0.50) SMN1; SMN2OPRM1OPRL1

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-11014964-B2 Peptide amide compound and preparation method and medical use thereof SICHUAN HAISCO PHARMACEUTICAL CO., LTD. (CN) 2021-05-25 US disclosed
US-20200172573-A1 PEPTIDE AMIDE COMPOUND AND PREPARATION METHOD AND MEDICAL USE THEREOF SICHUAN HAISCO PHARMACEUTICAL CO., LTD. (CN) 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 (2 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-20200172573-A1 PEPTIDE AMIDE COMPOUND AND PREPARATION METHOD AND MEDICAL USE THEREOF VIP, NPPA, GRPR SMN1; SMN2 2646/4885TOP2A 4632/4885TOP2B 4760/4885
US-11014964-B2 Peptide amide compound and preparation method and medical use thereof VIP, NPPA, GRPR SMN1; SMN2 2646/4885TOP2A 4632/4885TOP2B 4760/4885

“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.