SCHEMBL25842172

SCHEMBL25842172

CC(C)=CCc1ccc2c(CC(C)C(=O)O)c[nH]c2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.57
MAPT P10636 4/20 0.57
APAF1 O14727 1/20 0.57
POLB P06746 1/20 0.57
RECQL P46063 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
BLM P54132 3/20 0.41
ALOX15 P16050 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
PTPRA P18433 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
CYP2C19 P33261 1/20 0.40
TSHR P16473 3/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
PMP22 Q01453 2/20 0.40
MPO P05164 1/20 0.40
HIF1A Q16665 1/20 0.40
ACE P12821 2/20 0.39

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
SCHEMBL25304139 0.87 PTPRA (0.57) KDM4EMAPTAPAF1POLBRECQL
SCHEMBL25307935 0.87 PTPRA (0.57) KDM4EMAPTAPAF1POLBRECQL
SCHEMBL25842189 0.85 HTR2A (0.54) MAPTBLMNPSR1CYP2C19ALDH1A1
SCHEMBL25937517 0.83 PTPRA (0.46) KDM4EMAPTBLMALOX15NPSR1
SCHEMBL31549198 0.83 ALDH1A1 (0.48) KDM4EMAPTPOLBRECQLL3MBTL1
SCHEMBL12039399 0.78 KDM4E (0.68) KDM4EMAPTAPAF1POLBRECQL
SCHEMBL25842178 0.77 HTR2A (0.42) KMT2AMEN1HTR1AHTR2AHTR2C
SCHEMBL12039394 0.77 KDM4E (0.66) KDM4EMAPTAPAF1POLBRECQL
SCHEMBL16433255 0.77 NPC1 (0.50) KMT2AMEN1HTR1AHTR2AHTR2C
SCHEMBL25842170 0.76 MTNR1A (0.62) KDM4EMAPTBLMNPSR1CYP2C19

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-20230219888-A1 PRENYLATED PSILOCYBIN DERIVATIVES AND METHODS OF USING MAGICMED INDUSTRIES INC. (CA) 2023-07-13 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-20230219888-A1 PRENYLATED PSILOCYBIN DERIVATIVES AND METHODS OF USING AANAT, ACAT2, PCYT1A KDM4E 3448/4885MAPT 2331/4885APAF1 3764/4885

“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.