SCHEMBL25842177

SCHEMBL25842177

CCCc1c[nH]c2c(C)ccc(CC=C(C)C)c12

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.35
PTPN1 P18031 1/20 0.33
HTR2A P28223 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 3/20 0.31
HPGD P15428 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL25305253 0.88 HTR2A (0.47) PTPN1HTR2ASMN1; SMN2NPSR1MAPT
SCHEMBL25842179 0.80 SOS2 (0.49) HTR2ACYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL25842226 0.77 KDM4E (0.42) PTPN1SMN1; SMN2NPSR1MAPTHTT
SCHEMBL25842370 0.76 TNF (0.42) HTR2ANPSR1MAPTHPGDALDH1A1
SCHEMBL9965006 0.76 HTR2A (0.41) HTR2ASMN1; SMN2NPSR1MAPT
SCHEMBL25842164 0.72 CYP19A1 (0.38) CYP19A1HTR2ASMN1; SMN2NPSR1HTT
SCHEMBL26202274 0.72 MTNR1A (0.46) SMN1; SMN2NPSR1MAPTHPGDALDH1A1
SCHEMBL20553126 0.69 TNF (0.44) HTR2ANPSR1MAPTHPGDALDH1A1
SCHEMBL26203869 0.69 GPR84 (0.41) CYP19A1HTR2A
SCHEMBL10344946 0.67 SMN1; SMN2 (0.42) HTR2ASMN1; SMN2NPSR1MAPTHTT

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 CYP19A1 445/4885PTPN1 4404/4885HTR2A 1566/4885

“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.