SCHEMBL24746494

SCHEMBL24746494

COC(=O)CC1CCN(CCc2c[nH]c3ccccc23)CC1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ADRA2A P08913 1/20 0.61
▸ ADRA2B P18089 1/20 0.61
▸ ADRA2C P18825 1/20 0.61
▸ ADRA1D P25100 1/20 0.61
▸ ADRA1A P35348 1/20 0.61
▸ ADRA1B P35368 1/20 0.61
▸ BCHE P06276 6/20 0.60
▸ ACHE P22303 6/20 0.60
▸ HDAC8 Q9BY41 1/20 0.59
▸ HDAC6 Q9UBN7 1/20 0.59
▸ HTR2A P28223 1/20 0.57
▸ OPRM1 P35372 1/20 0.55
▸ OPRD1 P41143 1/20 0.55
▸ DRD2 P14416 2/20 0.53
▸ DRD3 P35462 1/20 0.53
▸ HPGD P15428 1/20 0.53
▸ HTR1A P08908 1/20 0.51

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
SCHEMBL24746501 0.86 ADRA2A (0.66) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL24746500 0.84 HPGD (0.66) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL5336211 0.83 HTR2A (0.64) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL5331541 0.81 HTR2A (0.68) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL5335494 0.81 HTR2A (0.68) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL24746502 0.80 HPGD (0.69) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL10854033 0.80 ADRA2A (0.77) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL24746503 0.80 HTR2A (0.74) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL24746495 0.79 ADRA2A (0.69) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL5332152 0.79 HTR2A (0.65) ADRA2AADRA2BADRA2CADRA1DADRA1A

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 6 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-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
US-11643391-B2 Prodrugs and conjugates of dimethyltryptamine ATAI THERAPEUTICS, INC. 2023-05-09 — — US disclosed
US-20230041584-A1 NOVEL PRODRUGS AND CONJUGATES OF DIMETHYLTRYPTAMINE ATAI THERAPEUTICS, INC. 2023-02-09 — — US disclosed
WO-2022261383-A1 NOVEL PRODRUGS AND CONJUGATES OF DIMETHYLTRYPTAMINE ATAI Life Sciences AG (DE) 2022-12-15 — — WO 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 (3 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-20230041584-A1 NOVEL PRODRUGS AND CONJUGATES OF DIMETHYLTRYPTAMINE NPY1R, NPY5R, HTR1A ADRA2A 126/4885ADRA2B 127/4885ADRA2C 142/4885
US-20230357146-A1 PRODRUGS AND CONJUGATES OF DIMETHYLTRYPTAMINE NPY1R, NPY5R, NPY2R ADRA2A 115/4885ADRA2B 131/4885ADRA2C 139/4885
US-11643391-B2 Prodrugs and conjugates of dimethyltryptamine NPY1R, NPY5R, NPY2R ADRA2A 115/4885ADRA2B 131/4885ADRA2C 139/4885

“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.

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