SCHEMBL25842170

SCHEMBL25842170

CC(=O)NCCc1c[nH]c2cc(CC=C(C)C)ccc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 15/20 0.62
MTNR1B P49286 15/20 0.62
CYP1A2 P05177 6/20 0.60
BLM P54132 3/20 0.60
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
LMNA P02545 2/20 0.60
CYP2C19 P33261 2/20 0.60
PKM P14618 1/20 0.60
TSHR P16473 1/20 0.60
CYP3A4 P08684 4/20 0.56
CYP2D6 P10635 4/20 0.56
NOTUM Q6P988 3/20 0.56
KDM4E B2RXH2 3/20 0.56
HPGD P15428 3/20 0.56
NPSR1 Q6W5P4 2/20 0.56
ALDH1A1 P00352 2/20 0.56
MAPT P10636 1/20 0.56
IDO1 P14902 1/20 0.56
SPR P35270 1/20 0.56

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
SCHEMBL4501209 0.85 MTNR1A (0.67) MTNR1AMTNR1BCYP1A2BLMMEN1
SCHEMBL25842178 0.82 HTR2A (0.42) MTNR1AMTNR1BMEN1KMT2AHTR2B
SCHEMBL16433255 0.82 NPC1 (0.50) MTNR1AMTNR1BMEN1KMT2ACYP2D6
SCHEMBL25260689 0.81 HTR2A (0.57) CYP1A2MEN1KMT2ATSHRCYP3A4
SCHEMBL29804890 0.81 HTR2A (0.57) CYP1A2MEN1KMT2ATSHRCYP3A4
SCHEMBL26202291 0.81 MTNR1A (0.59) MTNR1AMTNR1BCYP1A2BLMMEN1
SCHEMBL31549198 0.80 ALDH1A1 (0.48) MTNR1AMTNR1BMEN1KMT2ALMNA
SCHEMBL29799289 0.80 MTNR1A (0.61) MTNR1AMTNR1BCYP1A2BLMMEN1
SCHEMBL25381364 0.80 HTR2B (0.61) MTNR1AMTNR1BCYP1A2BLMMEN1
SCHEMBL25383197 0.80 MTNR1A (0.61) MTNR1AMTNR1BCYP1A2BLMMEN1

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-20230219888-A1 PRENYLATED PSILOCYBIN DERIVATIVES AND METHODS OF USING MAGICMED INDUSTRIES INC. (CA) 2023-07-13 US disclosed
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 MTNR1A 1294/4885MTNR1B 678/4885CYP1A2 241/4885

“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.