SCHEMBL26480243

SCHEMBL26480243

C[N+](C)(CCc1c[nH]c2ccccc12)COP(=O)(O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
MAPT P10636 3/20 0.49
POLB P06746 2/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
CDK4 P11802 2/20 0.47
CCND1 P24385 2/20 0.47
GAA P10253 2/20 0.46
CYP1A2 P05177 3/20 0.46
CYP2C19 P33261 2/20 0.46
LMNA P02545 2/20 0.46
PKM P14618 1/20 0.46
TSHR P16473 1/20 0.46
BLM P54132 1/20 0.46
ALDH1A1 P00352 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2D6 P10635 2/20 0.45
CYP2C9 P11712 1/20 0.45

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
SCHEMBL26479058 0.90 POLB (0.47) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL26479259 0.86 POLB (0.46) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL31066851 0.86 POLB (0.45) MEN1KMT2AMAPTPOLBNPC1
Potassium Ion SCHEMBL31066852 0.86 POLB (0.45) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL26479248 0.83 HTR2A (0.41) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL31066841 0.82 POLB (0.41) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL31066853 0.80 TRPV1 (0.41) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL26479105 0.78 HTR2A (0.54) MEN1KMT2AMAPTPOLBGAA
SCHEMBL31066855 0.78 KMT2A (0.43) MEN1KMT2AMAPTPOLBRAB9A
SCHEMBL4317964 0.78 ALDH1A1 (0.54) MEN1KMT2AMAPTNPC1RAB9A

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-20230357146-A1 PRODRUGS AND CONJUGATES OF DIMETHYLTRYPTAMINE ATAI THERAPEUTICS, INC. 2023-11-09 US disclosed
US-11643391-B2 Prodrugs and conjugates of dimethyltryptamine ATAI THERAPEUTICS, INC. 2023-05-09 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-20230357146-A1 PRODRUGS AND CONJUGATES OF DIMETHYLTRYPTAMINE NPY1R, NPY5R, NPY2R MEN1 495/4885KMT2A 662/4885MAPT 1338/4885
US-11643391-B2 Prodrugs and conjugates of dimethyltryptamine NPY1R, NPY5R, NPY2R MEN1 495/4885KMT2A 662/4885MAPT 1338/4885

“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.