SCHEMBL25858677

SCHEMBL25858677

CSC(=O)C(N)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2C P18825 1/20 0.42
HIF1A Q16665 1/20 0.42
KDM4E B2RXH2 1/20 0.42
CYP2D6 P10635 1/20 0.41
SRC P12931 1/20 0.41
CTRB1 P17538 2/20 0.41
DPP4 P27487 2/20 0.41
F2 P00734 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.40
ALOX5 P09917 1/20 0.40

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
SCHEMBL5565862 0.78 POLB (0.50) LMNACYP2D6SRCMAPK1
Phenylglycine SCHEMBL30631311 0.78 CYP2D6 (0.50) LMNAADRA2AADRA2CHIF1AKDM4E
SCHEMBL2586024 0.78 LMNA (0.48) LMNAADRA2AADRA2CHIF1AKDM4E
SCHEMBL11985509 0.78 LMNA (0.48) LMNAADRA2AADRA2CHIF1AKDM4E
SCHEMBL8279099 0.78 LMNA (0.48) LMNAADRA2AADRA2CHIF1AKDM4E
SCHEMBL5094452 0.77 PTGS2 (0.48) LMNAHIF1AKDM4ECYP2D6SRC
Hydrochloric Acid SCHEMBL3954994 0.76 ALDH1A1 (0.50) LMNAADRA2AADRA2CHIF1AKDM4E
SCHEMBL7309314 0.75 CYP2D6 (0.41) LMNAKDM4ECYP2D6SRCALDH1A1
Phenylglycine SCHEMBL31402004 0.75 CYP2D6 (0.56) LMNAKDM4ECYP2D6SRCDPP4
Phenylglycine SCHEMBL159420 0.75 CYP2D6 (0.56) LMNAKDM4ECYP2D6SRCDPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230227420-A1 PRODRUGS OF MDMA, MDA, AND DERIVATIVES THEREOF EMPATHBIO, INC. 2023-07-20 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-20230227420-A1 PRODRUGS OF MDMA, MDA, AND DERIVATIVES THEREOF COMT, PNMT, ABCB1 LMNA 2528/4885ADRA2A 394/4885ADRA2C 391/4885

“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.